-
1
-
-
36448933773
-
A de novo designed protein protein interface
-
Huang PS, Love JJ, Mayo SL. A de novo designed protein protein interface. Protein Sci 2007;16:2770-2774.
-
(2007)
Protein Sci
, vol.16
, pp. 2770-2774
-
-
Huang, P.S.1
Love, J.J.2
Mayo, S.L.3
-
2
-
-
77953808264
-
Computational design of a PAK1 binding protein
-
Jha RK, Leaver-Fay A, Yin S, Wu Y, Butterfoss GL, Szyperski T, V Dokholyan N, Kuhlman B. Computational design of a PAK1 binding protein. J Mol Biol 2010;400:257-270.
-
(2010)
J Mol Biol
, vol.400
, pp. 257-270
-
-
Jha, R.K.1
Leaver-Fay, A.2
Yin, S.3
Wu, Y.4
Butterfoss, G.L.5
Szyperski, T.6
Dokholyan, V.N.7
Kuhlman, B.8
-
3
-
-
79954633234
-
A de novo protein binding pair by computational design and directed evolution
-
Karanicolas J, Corn JE, Chen I, Joachimiak LA, Dym O, Peck SH, Albeck S, Unger T, Hu W, Liu G, Delbecq S, Montelione GT, Spiegel CP, Liu DR, Baker D. A de novo protein binding pair by computational design and directed evolution. Mol Cell 2011;42:250-260.
-
(2011)
Mol Cell
, vol.42
, pp. 250-260
-
-
Karanicolas, J.1
Corn, J.E.2
Chen, I.3
Joachimiak, L.A.4
Dym, O.5
Peck, S.H.6
Albeck, S.7
Unger, T.8
Hu, W.9
Liu, G.10
Delbecq, S.11
Montelione, G.T.12
Spiegel, C.P.13
Liu, D.R.14
Baker, D.15
-
4
-
-
79956017135
-
Computational design of proteins targeting the conserved stem region of influenza hemagglutinin
-
Fleishman SJ, Whitehead TA, Ekiert DC, Dreyfus C, Corn JE, Strauch EM, Wilson IA, and Baker D. Computational design of proteins targeting the conserved stem region of influenza hemagglutinin. Science 2011;332:816-821.
-
(2011)
Science
, vol.332
, pp. 816-821
-
-
Fleishman, S.J.1
Whitehead, T.A.2
Ekiert, D.C.3
Dreyfus, C.4
Corn, J.E.5
Strauch, E.M.6
Wilson, I.A.7
Baker, D.8
-
6
-
-
84883277095
-
Computational design of a protein-based enzyme inhibitor
-
Procko E, Hedman R, Hamilton K, Seetharaman J, Fleishman SJ, Su M, Aramini J, Kornhaber G, Hunt JF, Tong L, Montelione GT, Baker D. Computational design of a protein-based enzyme inhibitor. J Mol Biol 2013;425:3563-3575.
-
(2013)
J Mol Biol
, vol.425
, pp. 3563-3575
-
-
Procko, E.1
Hedman, R.2
Hamilton, K.3
Seetharaman, J.4
Fleishman, S.J.5
Su, M.6
Aramini, J.7
Kornhaber, G.8
Hunt, J.F.9
Tong, L.10
Montelione, G.T.11
Baker, D.12
-
7
-
-
80855140813
-
Hotspot-centric de novo design of protein binders
-
Fleishman SJ, Corn JE, Strauch E-M, a Whitehead T, Karanicolas J, Baker D. Hotspot-centric de novo design of protein binders. J Mol Biol 2011;413:1047-1062.
-
(2011)
J Mol Biol
, vol.413
, pp. 1047-1062
-
-
Fleishman, S.J.1
Corn, J.E.2
Strauch, E.-M.3
a Whitehead, T.4
Karanicolas, J.5
Baker, D.6
-
8
-
-
84861676223
-
Computational design of self-assembling protein nanomaterials with atomic level accuracy
-
King NP, Sheffler W, Sawaya MR, Vollmar BS, Sumida JP, André I, Gonen T, Yeates TO, Baker D. Computational design of self-assembling protein nanomaterials with atomic level accuracy. Science 2012;336:1171-1174.
-
(2012)
Science
, vol.336
, pp. 1171-1174
-
-
King, N.P.1
Sheffler, W.2
Sawaya, M.R.3
Vollmar, B.S.4
Sumida, J.P.5
André, I.6
Gonen, T.7
Yeates, T.O.8
Baker, D.9
-
9
-
-
84879093742
-
Design of a single-chain polypeptide tetrahedron assembled from coiled-coil segments
-
Gradišar H, Božic S, Doles T, Vengust D, Hafner-Bratkovic I, Mertelj A, Webb B, Šali A, Klavžar S, Jerala R. Design of a single-chain polypeptide tetrahedron assembled from coiled-coil segments. Nat Chem Biol 2013;9:362-366.
-
(2013)
Nat Chem Biol
, vol.9
, pp. 362-366
-
-
Gradišar, H.1
Božic, S.2
Doles, T.3
Vengust, D.4
Hafner-Bratkovic, I.5
Mertelj, A.6
Webb, B.7
Šali, A.8
Klavžar, S.9
Jerala, R.10
-
10
-
-
84877588832
-
Self-assembling cages from coiled-coil peptide modules
-
Fletcher JM, Harniman RL, Barnes FRH, Boyle AL, Collins A, Mantell J, Sharp TH, Antognozzi M, Booth PJ, Linden N, Miles MJ, Sessions RB, Verkade P, Woolfson DN. Self-assembling cages from coiled-coil peptide modules. Science 2013;340:595-599.
-
(2013)
Science
, vol.340
, pp. 595-599
-
-
Fletcher, J.M.1
Harniman, R.L.2
Barnes, F.R.H.3
Boyle, A.L.4
Collins, A.5
Mantell, J.6
Sharp, T.H.7
Antognozzi, M.8
Booth, P.J.9
Linden, N.10
Miles, M.J.11
Sessions, R.B.12
Verkade, P.13
Woolfson, D.N.14
-
11
-
-
84855514179
-
Computational design of a symmetric homodimer using β-strand assembly
-
Stranges PB, Machius M, Miley MJ, Tripathy A, Kuhlman B. Computational design of a symmetric homodimer using β-strand assembly. Proc Natl Acad Sci USA 2011;108:20562-20567.
-
(2011)
Proc Natl Acad Sci USA
, vol.108
, pp. 20562-20567
-
-
Stranges, P.B.1
Machius, M.2
Miley, M.J.3
Tripathy, A.4
Kuhlman, B.5
-
12
-
-
84855685292
-
Metal-mediated affinity and orientation specificity in a computationally designed protein homodimer
-
Der BS, Machius M, Miley MJ, Mills JL, Szyperski T, Kuhlman B. Metal-mediated affinity and orientation specificity in a computationally designed protein homodimer. J Am Chem Soc 2012;134:375-385.
-
(2012)
J Am Chem Soc
, vol.134
, pp. 375-385
-
-
Der, B.S.1
Machius, M.2
Miley, M.J.3
Mills, J.L.4
Szyperski, T.5
Kuhlman, B.6
-
13
-
-
0003187567
-
The atomic structure of protein-protein recognition sites
-
Lo Conte L, Chothia C, Janin J. The atomic structure of protein-protein recognition sites. J Mol Biol 1999;285:2177-2198.
-
(1999)
J Mol Biol
, vol.285
, pp. 2177-2198
-
-
Lo Conte, L.1
Chothia, C.2
Janin, J.3
-
14
-
-
80054899738
-
Community-wide assessment of protein-interface modeling suggests improvements to design methodology
-
Fleishman SJ, Whitehead TA, Strauch E-M, Corn JE, Qin S, Zhou H-X, Mitchell JC, a Demerdash ON, Takeda-Shitaka M, Terashi G, Moal IH, Li X, a Bates P, Zacharias M, Park H, Ko J, Lee H, Seok C, Bourquard T, Bernauer J, Poupon A, Azé J, Soner S, Ovali SK, Ozbek P, Ben Tal N, Haliloglu T, Hwang H, Vreven T, Pierce BG, Weng Z, Pérez-Cano L, Pons C, Fernández-Recio J, Jiang F, Yang F, Gong X, Cao L, Xu X, Liu B, Wang P, Li C, Wang C, Robert CH, Guharoy M, Liu S, Huang Y, Li L, Guo D, Chen Y, Xiao Y, London N, Itzhaki Z, Schueler-Furman O, Inbar Y, Potapov V, Cohen M, Schreiber G, Tsuchiya Y, Kanamori E, Standley DM, Nakamura H, Kinoshita K, Driggers CM, Hall RG, Morgan JL, Hsu VL, Zhan J, Yang Y, Zhou Y, Kastritis PL, Bonvin AMJJ, Zhang W, Camacho CJ, Kilambi KP, Sircar A, Gray JJ, Ohue M, Uchikoga N, Matsuzaki Y, Ishida T, Akiyama Y, Khashan R, Bush S, Fouches D, Tropsha A, Esquivel-Rodríguez J, Kihara D, Stranges PB, Jacak R, Kuhlman B, Huang S-Y, Zou X, Wodak SJ, Janin J, Baker D. Community-wide assessment of protein-interface modeling suggests improvements to design methodology. J Mol Biol 2011;414:289-302.
-
(2011)
J Mol Biol
, vol.414
, pp. 289-302
-
-
Fleishman, S.J.1
Whitehead, T.A.2
Strauch, E.-M.3
Corn, J.E.4
Qin, S.5
Zhou, H.-X.6
Mitchell, J.C.7
a Demerdash, O.N.8
Takeda-Shitaka, M.9
Terashi, G.10
Moal, I.H.11
Li, X.12
a Bates, P.13
Zacharias, M.14
Park, H.15
Ko, J.16
Lee, H.17
Seok, C.18
Bourquard, T.19
Bernauer, J.20
Poupon, A.21
Azé, J.22
Soner, S.23
Ovali, S.K.24
Ozbek, P.25
Ben Tal, N.26
Haliloglu, T.27
Hwang, H.28
Vreven, T.29
Pierce, B.G.30
Weng, Z.31
Pérez-Cano, L.32
Pons, C.33
Fernández-Recio, J.34
Jiang, F.35
Yang, F.36
Gong, X.37
Cao, L.38
Xu, X.39
Liu, B.40
Wang, P.41
Li, C.42
Wang, C.43
Robert, C.H.44
Guharoy, M.45
Liu, S.46
Huang, Y.47
Li, L.48
Guo, D.49
Chen, Y.50
Xiao, Y.51
London, N.52
Itzhaki, Z.53
Schueler-Furman, O.54
Inbar, Y.55
Potapov, V.56
Cohen, M.57
Schreiber, G.58
Tsuchiya, Y.59
Kanamori, E.60
Standley, D.M.61
Nakamura, H.62
Kinoshita, K.63
Driggers, C.M.64
Hall, R.G.65
Morgan, J.L.66
Hsu, V.L.67
Zhan, J.68
Yang, Y.69
Zhou, Y.70
Kastritis, P.L.71
Bonvin, A.M.J.J.72
Zhang, W.73
Camacho, C.J.74
Kilambi, K.P.75
Sircar, A.76
Gray, J.J.77
Ohue, M.78
Uchikoga, N.79
Matsuzaki, Y.80
Ishida, T.81
Akiyama, Y.82
Khashan, R.83
Bush, S.84
Fouches, D.85
Tropsha, A.86
Esquivel-Rodríguez, J.87
Kihara, D.88
Stranges, P.B.89
Jacak, R.90
Kuhlman, B.91
Huang, S.-Y.92
Zou, X.93
Wodak, S.J.94
Janin, J.95
Baker, D.96
more..
-
15
-
-
84885836021
-
Community-wide evaluation of methods for predicting the effect of mutations on protein-protein interactions
-
Moretti R, Fleishman SJ, Agius R, Torchala M, a Bates P, Kastritis PL, Rodrigues JPGLM, Trellet M, Bonvin AMJJ, Cui M, Rooman M, Gillis D, Dehouck Y, Moal I, Romero-Durana M, Perez-Cano L, Pallara C, Jimenez B, Fernandez-Recio J, Flores S, Pacella M, Praneeth Kilambi K, Gray JJ, Popov P, Grudinin S, Esquivel-Rodríguez J, Kihara D, Zhao N, Korkin D, Zhu X, a Demerdash ON, Mitchell JC, Kanamori E, Tsuchiya Y, Nakamura H, Lee H, Park H, Seok C, Sarmiento J, Liang S, Teraguchi S, Standley DM, Shimoyama H, Terashi G, Takeda-Shitaka M, Iwadate M, Umeyama H, Beglov D, Hall DR, Kozakov D, Vajda S, Pierce BG, Hwang H, Vreven T, Weng Z, Huang Y, Li H, Yang X, Ji X, Liu S, Xiao Y, Zacharias M, Qin S, Zhou H-X, Huang S-Y, Zou X, Velankar S, Janin J, Wodak SJ, Baker D. Community-wide evaluation of methods for predicting the effect of mutations on protein-protein interactions. Proteins 2013;81:1980-1987.
-
(2013)
Proteins
, vol.81
, pp. 1980-1987
-
-
Moretti, R.1
Fleishman, S.J.2
Agius, R.3
Torchala, M.4
a Bates, P.5
Kastritis, P.L.6
Rodrigues, J.P.G.L.M.7
Trellet, M.8
Bonvin, A.M.J.J.9
Cui, M.10
Rooman, M.11
Gillis, D.12
Dehouck, Y.13
Moal, I.14
Romero-Durana, M.15
Perez-Cano, L.16
Pallara, C.17
Jimenez, B.18
Fernandez-Recio, J.19
Flores, S.20
Pacella, M.21
Praneeth Kilambi, K.22
Gray, J.J.23
Popov, P.24
Grudinin, S.25
Esquivel-Rodríguez, J.26
Kihara, D.27
Zhao, N.28
Korkin, D.29
Zhu, X.30
a Demerdash, O.N.31
Mitchell, J.C.32
Kanamori, E.33
Tsuchiya, Y.34
Nakamura, H.35
Lee, H.36
Park, H.37
Seok, C.38
Sarmiento, J.39
Liang, S.40
Teraguchi, S.41
Standley, D.M.42
Shimoyama, H.43
Terashi, G.44
Takeda-Shitaka, M.45
Iwadate, M.46
Umeyama, H.47
Beglov, D.48
Hall, D.R.49
Kozakov, D.50
Vajda, S.51
Pierce, B.G.52
Hwang, H.53
Vreven, T.54
Weng, Z.55
Huang, Y.56
Li, H.57
Yang, X.58
Ji, X.59
Liu, S.60
Xiao, Y.61
Zacharias, M.62
Qin, S.63
Zhou, H.-X.64
Huang, S.-Y.65
Zou, X.66
Velankar, S.67
Janin, J.68
Wodak, S.J.69
Baker, D.70
more..
-
16
-
-
84873024403
-
A comparison of successful and failed protein interface designs highlights the challenges of designing buried hydrogen bonds
-
Stranges PB, Kuhlman B. A comparison of successful and failed protein interface designs highlights the challenges of designing buried hydrogen bonds. Protein Sci 2013;22:74-82.
-
(2013)
Protein Sci
, vol.22
, pp. 74-82
-
-
Stranges, P.B.1
Kuhlman, B.2
-
17
-
-
84876020987
-
Emerging themes in the computational design of novel enzymes and protein-protein interfaces
-
Khare SD, Fleishman SJ. Emerging themes in the computational design of novel enzymes and protein-protein interfaces. FEBS Lett 2013;587:1147-1154.
-
(2013)
FEBS Lett
, vol.587
, pp. 1147-1154
-
-
Khare, S.D.1
Fleishman, S.J.2
-
18
-
-
84859765617
-
Role of the biomolecular energy gap in protein design, structure, and evolution
-
Fleishman SJ, Baker D. Role of the biomolecular energy gap in protein design, structure, and evolution. Cell 2012;149:262-273.
-
(2012)
Cell
, vol.149
, pp. 262-273
-
-
Fleishman, S.J.1
Baker, D.2
-
19
-
-
0345306764
-
Design of a novel globular protein fold with atomic-level accuracy
-
Kuhlman B, Dantas G, Ireton GC, Varani G, Stoddard BL, Baker D. Design of a novel globular protein fold with atomic-level accuracy. Science 2003;302:1364-1368.
-
(2003)
Science
, vol.302
, pp. 1364-1368
-
-
Kuhlman, B.1
Dantas, G.2
Ireton, G.C.3
Varani, G.4
Stoddard, B.L.5
Baker, D.6
-
20
-
-
33751525692
-
New algorithms and an in silico benchmark for computational enzyme design
-
Zanghellini A, Jiang L, Wollacott AM, Cheng G, Meiler J, Althoff EA, Röthlisberger D, Baker D. New algorithms and an in silico benchmark for computational enzyme design. Protein Sci 2006;15:2785-2794.
-
(2006)
Protein Sci
, vol.15
, pp. 2785-2794
-
-
Zanghellini, A.1
Jiang, L.2
Wollacott, A.M.3
Cheng, G.4
Meiler, J.5
Althoff, E.A.6
Röthlisberger, D.7
Baker, D.8
-
21
-
-
0014828908
-
An analysis of the sequences of the variable regions of bence jones proteins and myeloma light chains and their implications for antibody complementarity
-
Wu, T, Te Kabat, E. An analysis of the sequences of the variable regions of bence jones proteins and myeloma light chains and their implications for antibody complementarity. J Exp Med 1970;132:211-250.
-
(1970)
J Exp Med
, vol.132
, pp. 211-250
-
-
Wu, T.1
Te Kabat, E.2
-
22
-
-
0023278330
-
Canonical structures for the hypervariable regions of immunoglobulins
-
Chothia C, Lesk AM. Canonical structures for the hypervariable regions of immunoglobulins. J Mol Biol 1987;196:901-917.
-
(1987)
J Mol Biol
, vol.196
, pp. 901-917
-
-
Chothia, C.1
Lesk, A.M.2
-
23
-
-
0015146402
-
A homologous series of affinity labeling reagents and their use in the study of antibody binding sites
-
Strausbauch PH, Weinstein Y, Wilchek M, Shaltiel S, Givol D. A homologous series of affinity labeling reagents and their use in the study of antibody binding sites. Biochemistry 1971;10:4342-4348.
-
(1971)
Biochemistry
, vol.10
, pp. 4342-4348
-
-
Strausbauch, P.H.1
Weinstein, Y.2
Wilchek, M.3
Shaltiel, S.4
Givol, D.5
-
24
-
-
79251598995
-
A new clustering of antibody CDR loop conformations
-
North B, Lehmann A, Dunbrack RL. A new clustering of antibody CDR loop conformations. J Mol Biol 2011;406:228-256.
-
(2011)
J Mol Biol
, vol.406
, pp. 228-256
-
-
North, B.1
Lehmann, A.2
Dunbrack, R.L.3
-
25
-
-
0031558798
-
Standard conformations for the canonical structures of immunoglobulins
-
Al-Lazikani B, Lesk AM, Chothia C. Standard conformations for the canonical structures of immunoglobulins. J Mol Biol 1997;273:927-948.
-
(1997)
J Mol Biol
, vol.273
, pp. 927-948
-
-
Al-Lazikani, B.1
Lesk, A.M.2
Chothia, C.3
-
26
-
-
0004032583
-
-
5th ed. Bethesda, Maryland: National Institutes of Health;.
-
Kabat EA, Wu TT, Perry HM, Gottesman KS, Foeller C. Sequences of proteins of immunological interest, 5th ed. Bethesda, Maryland: National Institutes of Health; 1991.
-
(1991)
Sequences of proteins of immunological interest
-
-
Kabat, E.A.1
Wu, T.T.2
Perry, H.M.3
Gottesman, K.S.4
Foeller, C.5
-
27
-
-
0017747498
-
Unusual distributions of amino acids in complementarity-determining (hypervariable) segments of heavy and light chains of immunoglobulins and their possible roles in specificity of antibody-combining sites
-
Kabat EA, Wu TT, Bilofsky H. Unusual distributions of amino acids in complementarity-determining (hypervariable) segments of heavy and light chains of immunoglobulins and their possible roles in specificity of antibody-combining sites. J Biol Chem 1977;252:6609-6616.
-
(1977)
J Biol Chem
, vol.252
, pp. 6609-6616
-
-
Kabat, E.A.1
Wu, T.T.2
Bilofsky, H.3
-
28
-
-
84879549646
-
What makes a protein fold amenable to functional innovation? Fold polarity and stability trade-offs
-
Dellus-Gur E, Toth-Petroczy A, Elias M, Tawfik DS. What makes a protein fold amenable to functional innovation? Fold polarity and stability trade-offs. J Mol Biol 2013;425:2609-2621.
-
(2013)
J Mol Biol
, vol.425
, pp. 2609-2621
-
-
Dellus-Gur, E.1
Toth-Petroczy, A.2
Elias, M.3
Tawfik, D.S.4
-
29
-
-
0020429363
-
Evolution of proteins formed by β-sheets: II. The core of the immunoglobulin domains
-
Lesk A, Chothia C. Evolution of proteins formed by β-sheets: II. The core of the immunoglobulin domains. J Mol Biol 1982;160:325-342.
-
(1982)
J Mol Biol
, vol.160
, pp. 325-342
-
-
Lesk, A.1
Chothia, C.2
-
31
-
-
0022558297
-
Replacing the complementarity-determining regions in a human antibody with those from a mouse
-
Jones P, Dear P, Foote J, Neuberger M, Winter G. Replacing the complementarity-determining regions in a human antibody with those from a mouse. Nature 1986;321:522-525.
-
(1986)
Nature
, vol.321
, pp. 522-525
-
-
Jones, P.1
Dear, P.2
Foote, J.3
Neuberger, M.4
Winter, G.5
-
32
-
-
0025978976
-
Man-made antibodies
-
Winter G, Milstein C. Man-made antibodies. Nature 1991;349:293-299.
-
(1991)
Nature
, vol.349
, pp. 293-299
-
-
Winter, G.1
Milstein, C.2
-
33
-
-
43749108590
-
Submitting antibodies to binding arbitration
-
Michnick SW, Sidhu SS. Submitting antibodies to binding arbitration. Nat Chem Biol 2008;4:326-329.
-
(2008)
Nat Chem Biol
, vol.4
, pp. 326-329
-
-
Michnick, S.W.1
Sidhu, S.S.2
-
34
-
-
77951586447
-
Strategies and challenges for the next generation of therapeutic antibodies
-
Beck A, Wurch T, Bailly C, Corvaia N. Strategies and challenges for the next generation of therapeutic antibodies. Nat Rev Immunol 2010;10:345-352.
-
(2010)
Nat Rev Immunol
, vol.10
, pp. 345-352
-
-
Beck, A.1
Wurch, T.2
Bailly, C.3
Corvaia, N.4
-
35
-
-
34248551662
-
Antibody engineering and modification technologies
-
Filpula D. Antibody engineering and modification technologies. Biomol Eng 2007;24:201-215.
-
(2007)
Biomol Eng
, vol.24
, pp. 201-215
-
-
Filpula, D.1
-
37
-
-
84859510667
-
Broadly neutralizing antibodies against influenza virus and prospects for universal therapies
-
Ekiert DC, Wilson IA. Broadly neutralizing antibodies against influenza virus and prospects for universal therapies. Curr Opin Virol 2012;2:134-141.
-
(2012)
Curr Opin Virol
, vol.2
, pp. 134-141
-
-
Ekiert, D.C.1
Wilson, I.A.2
-
38
-
-
0033855859
-
Clinical trials of antibody therapy
-
Glennie MJ, Johnson PW. Clinical trials of antibody therapy. Immunol Today 2000;21:403-410.
-
(2000)
Immunol Today
, vol.21
, pp. 403-410
-
-
Glennie, M.J.1
Johnson, P.W.2
-
39
-
-
0037022297
-
Conformational abs recognizing a generic amyloid fibril epitope
-
O'Nuallain B, Wetzel R. Conformational abs recognizing a generic amyloid fibril epitope. Proc Natl Acad Sci USA 2002;99:1485-1490.
-
(2002)
Proc Natl Acad Sci USA
, vol.99
, pp. 1485-1490
-
-
O'Nuallain, B.1
Wetzel, R.2
-
41
-
-
9444277172
-
Single-chain antibodies for the conformation-specific blockade of activated platelet integrin alphaIIbbeta3 designed by subtractive selection from naive human phage libraries
-
Schwarz M, Röttgen P, Takada Y, Le Gall F, Knackmuss S, Bassler N, Büttner C, Little M, Bode C, Peter K. Single-chain antibodies for the conformation-specific blockade of activated platelet integrin alphaIIbbeta3 designed by subtractive selection from naive human phage libraries. FASEB J 2004;18:1704-1706.
-
(2004)
FASEB J
, vol.18
, pp. 1704-1706
-
-
Schwarz, M.1
Röttgen, P.2
Takada, Y.3
Le Gall, F.4
Knackmuss, S.5
Bassler, N.6
Büttner, C.7
Little, M.8
Bode, C.9
Peter, K.10
-
42
-
-
78149242586
-
Elicitation of structure-specific antibodies by epitope scaffolds
-
Ofek G, Guenaga FJ, Schief WR, Skinner J, Baker D, Wyatt R, Kwong PD. Elicitation of structure-specific antibodies by epitope scaffolds. Proc Natl Acad Sci USA 2010;107:17880-17887.
-
(2010)
Proc Natl Acad Sci USA
, vol.107
, pp. 17880-17887
-
-
Ofek, G.1
Guenaga, F.J.2
Schief, W.R.3
Skinner, J.4
Baker, D.5
Wyatt, R.6
Kwong, P.D.7
-
43
-
-
84878349946
-
Structure of RSV fusion glycoprotein trimer bound to a prefusion-specific neutralizing antibody
-
McLellan JS, Chen M, Leung S, Graepel KW, Du X, Yang Y, Zhou T, Baxa U, Yasuda E, Beaumont T, Kumar A, Modjarrad K, Zheng Z, Zhao M, Xia N, Kwong PD, Graham BS. Structure of RSV fusion glycoprotein trimer bound to a prefusion-specific neutralizing antibody. Science 2013;340:1113-1117.
-
(2013)
Science
, vol.340
, pp. 1113-1117
-
-
McLellan, J.S.1
Chen, M.2
Leung, S.3
Graepel, K.W.4
Du, X.5
Yang, Y.6
Zhou, T.7
Baxa, U.8
Yasuda, E.9
Beaumont, T.10
Kumar, A.11
Modjarrad, K.12
Zheng, Z.13
Zhao, M.14
Xia, N.15
Kwong, P.D.16
Graham, B.S.17
-
44
-
-
58049198443
-
Heterosubtypic neutralizing monoclonal antibodies cross-protective against H5N1 and H1N1 recovered from human IgM+ memory B cells
-
Throsby M, van den Brink E, Jongeneelen M, Poon LLM, Alard P, Cornelissen L, Bakker A, Cox F, van Deventer E, Guan Y, Cinatl J, ter Meulen J, Lasters I, Carsetti R, Peiris M, de Kruif J, Goudsmit J. Heterosubtypic neutralizing monoclonal antibodies cross-protective against H5N1 and H1N1 recovered from human IgM+ memory B cells. PLoS One 2008;3:e3942.
-
(2008)
PLoS One
, vol.3
, pp. e3942
-
-
Throsby, M.1
van den Brink, E.2
Jongeneelen, M.3
Poon, L.L.M.4
Alard, P.5
Cornelissen, L.6
Bakker, A.7
Cox, F.8
van Deventer, E.9
Guan, Y.10
Cinatl, J.11
ter Meulen, J.12
Lasters, I.13
Carsetti, R.14
Peiris, M.15
de Kruif, J.16
Goudsmit, J.17
-
45
-
-
33646146483
-
Affinity enhancement of an in vivo matured therapeutic antibody using structure-based computational design
-
Fleishman SJ, Leaver-Fay A, Corn JE, Strauch E-M, Khare SD, Koga N, Ashworth J, Murphy P, Richter F, Lemmon G, Meiler J, Baker D. Affinity enhancement of an in vivo matured therapeutic antibody using structure-based computational design. Protein Sci 2006;15:949-960.
-
(2006)
Protein Sci
, vol.15
, pp. 949-960
-
-
Fleishman, S.J.1
Leaver-Fay, A.2
Corn, J.E.3
Strauch, E.-M.4
Khare, S.D.5
Koga, N.6
Ashworth, J.7
Murphy, P.8
Richter, F.9
Lemmon, G.10
Meiler, J.11
Baker, D.12
-
46
-
-
35148855712
-
Computational design of antibody-affinity improvement beyond in vivo maturation
-
Lippow SM, Wittrup KD, Tidor B. Computational design of antibody-affinity improvement beyond in vivo maturation. Nat Biotechnol 2007;25:1171-1176.
-
(2007)
Nat Biotechnol
, vol.25
, pp. 1171-1176
-
-
Lippow, S.M.1
Wittrup, K.D.2
Tidor, B.3
-
47
-
-
61849182503
-
An antibody loop replacement design feasibility study and a loop-swapped dimer structure
-
Clark L, Boriack-Sjodin PA, Day E, Eldredge J, Fitch C, Jarpe M, Miller S, Li Y, Simon K, van Vlijmen HWT. An antibody loop replacement design feasibility study and a loop-swapped dimer structure. Protein Eng Des Sel 2009;22:93-101.
-
(2009)
Protein Eng Des Sel
, vol.22
, pp. 93-101
-
-
Clark, L.1
Boriack-Sjodin, P.A.2
Day, E.3
Eldredge, J.4
Fitch, C.5
Jarpe, M.6
Miller, S.7
Li, Y.8
Simon, K.9
van Vlijmen, H.W.T.10
-
48
-
-
48249111382
-
Affinity maturation of antibodies assisted by in silico modeling
-
Barderas R, Desmet J, Timmerman P, Meloen R, Casal JI. Affinity maturation of antibodies assisted by in silico modeling. Proc Natl Acad Sci USA 2008;105:9029-9034.
-
(2008)
Proc Natl Acad Sci USA
, vol.105
, pp. 9029-9034
-
-
Barderas, R.1
Desmet, J.2
Timmerman, P.3
Meloen, R.4
Casal, J.I.5
-
49
-
-
67649647815
-
Improving the species cross-reactivity of an antibody using computational design
-
Farady CJ, Sellers BD, Jacobson MP, Craik CS. Improving the species cross-reactivity of an antibody using computational design. Bioorg Med Chem Lett 2009;19:3744-3747.
-
(2009)
Bioorg Med Chem Lett
, vol.19
, pp. 3744-3747
-
-
Farady, C.J.1
Sellers, B.D.2
Jacobson, M.P.3
Craik, C.S.4
-
50
-
-
84860145921
-
Structure-based design of supercharged, highly thermoresistant antibodies
-
Miklos AE, Kluwe C, Der BS, Pai S, Sircar A, a Hughes R, Berrondo M, Xu J, Codrea V, Buckley PE, Calm AM, Welsh HS, Warner CR, a Zacharko M, Carney JP, Gray JJ, Georgiou G, Kuhlman B, Ellington AD. Structure-based design of supercharged, highly thermoresistant antibodies. Chem Biol 2012;19:449-455.
-
(2012)
Chem Biol
, vol.19
, pp. 449-455
-
-
Miklos, A.E.1
Kluwe, C.2
Der, B.S.3
Pai, S.4
Sircar, A.5
a Hughes, R.6
Berrondo, M.7
Xu, J.8
Codrea, V.9
Buckley, P.E.10
Calm, A.M.11
Welsh, H.S.12
Warner, C.R.13
a Zacharko, M.14
Carney, J.P.15
Gray, J.J.16
Georgiou, G.17
Kuhlman, B.18
Ellington, A.D.19
-
51
-
-
77958157337
-
OptCDR: a general computational method for the design of antibody complementarity determining regions for targeted epitope binding
-
Pantazes RJ, Maranas CD. OptCDR: a general computational method for the design of antibody complementarity determining regions for targeted epitope binding. Protein Eng Des Sel 2010;23:849-858.
-
(2010)
Protein Eng Des Sel
, vol.23
, pp. 849-858
-
-
Pantazes, R.J.1
Maranas, C.D.2
-
52
-
-
84878255395
-
MAPs: a database of modular antibody parts for predicting tertiary structures and designing affinity matured antibodies
-
Pantazes RJ, Maranas CD. MAPs: a database of modular antibody parts for predicting tertiary structures and designing affinity matured antibodies. BMC Bioinform 2013;14:168.
-
(2013)
BMC Bioinform
, vol.14
, pp. 168
-
-
Pantazes, R.J.1
Maranas, C.D.2
-
53
-
-
84937737866
-
OptMAVEn-a new framework for the de novo design of antibody variable region models targeting specific antigen epitopes
-
Li T, Pantazes RJ, Maranas CD. OptMAVEn-a new framework for the de novo design of antibody variable region models targeting specific antigen epitopes. PLoS One 2014;9:e105954.
-
(2014)
PLoS One
, vol.9
, pp. e105954
-
-
Li, T.1
Pantazes, R.J.2
Maranas, C.D.3
-
54
-
-
50649095790
-
Macromolecular modeling with Rosetta
-
Das R, Baker D. Macromolecular modeling with Rosetta. Annu Rev Biochem 2008;77:363-382.
-
(2008)
Annu Rev Biochem
, vol.77
, pp. 363-382
-
-
Das, R.1
Baker, D.2
-
55
-
-
79959615159
-
RosettaScripts: a scripting language interface to the Rosetta macromolecular modeling suite
-
Fleishman SJ, Leaver-Fay A, Corn JE, Strauch E-M, Khare SD, Koga N, Ashworth J, Murphy P, Richter F, Lemmon G, Meiler J, Baker D. RosettaScripts: a scripting language interface to the Rosetta macromolecular modeling suite. PLoS One 2011;6:e20161.
-
(2011)
PLoS One
, vol.6
-
-
Fleishman S.J.Leaver-Fay, A.1
Corn, J.E.2
Strauch, E-M.3
Khare, S.D.4
Koga, N.5
Ashworth, J.6
Murphy, P.7
Richter, F.8
Lemmon, G.9
Meiler, J.10
Baker, D.11
-
56
-
-
84874032378
-
Computational design of novel protein binders and experimental affinity maturation
-
Whitehead TA, Baker D, Fleishman SJ. Computational design of novel protein binders and experimental affinity maturation. Methods Enzymol 2013;523:1-19.
-
(2013)
Methods Enzymol
, vol.523
, pp. 1-19
-
-
Whitehead, T.A.1
Baker, D.2
Fleishman, S.J.3
-
57
-
-
0038021436
-
Assessment of blind predictions of protein-protein interactions: current status of docking methods
-
Méndez R, Leplae R, De Maria L, Wodak SJ. Assessment of blind predictions of protein-protein interactions: current status of docking methods. Proteins 2003;52:51-67.
-
(2003)
Proteins
, vol.52
, pp. 51-67
-
-
Méndez, R.1
Leplae, R.2
De Maria, L.3
Wodak, S.J.4
-
58
-
-
0027772959
-
Shape complementarity at protein/protein interfaces
-
Lawrence MC, Colman PM. Shape complementarity at protein/protein interfaces. J Mol Biol 1993;234:946-950.
-
(1993)
J Mol Biol
, vol.234
, pp. 946-950
-
-
Lawrence, M.C.1
Colman, P.M.2
-
59
-
-
58149463441
-
RosettaHoles: rapid assessment of protein core packing for structure prediction, refinement, design, and validation
-
Sheffler W, Baker D. RosettaHoles: rapid assessment of protein core packing for structure prediction, refinement, design, and validation. Protein Sci 2009;18:229-239.
-
(2009)
Protein Sci
, vol.18
, pp. 229-239
-
-
Sheffler, W.1
Baker, D.2
-
61
-
-
0038161052
-
Protein-protein docking with simultaneous optimization of rigid-body displacement and side-chain conformations
-
Gray JJ, Moughon S, Wang C, Schueler-Furman O, Kuhlman B, Rohl CA, Baker D. Protein-protein docking with simultaneous optimization of rigid-body displacement and side-chain conformations. J Mol Biol 2003;331:281-299.
-
(2003)
J Mol Biol
, vol.331
, pp. 281-299
-
-
Gray, J.J.1
Moughon, S.2
Wang, C.3
Schueler-Furman, O.4
Kuhlman, B.5
Rohl, C.A.6
Baker, D.7
-
62
-
-
79953169868
-
Restricted sidechain plasticity in the structures of native proteins and complexes
-
Fleishman SJ, Khare SD, Koga N, Baker D. Restricted sidechain plasticity in the structures of native proteins and complexes. Protein Sci 2011;20:753-757.
-
(2011)
Protein Sci
, vol.20
, pp. 753-757
-
-
Fleishman, S.J.1
Khare, S.D.2
Koga, N.3
Baker, D.4
-
63
-
-
0037195144
-
A simple physical model for binding energy hot spots in protein-protein complexes
-
Kortemme T, Baker D. A simple physical model for binding energy hot spots in protein-protein complexes. Proc Natl Acad Sci USA 2002;99:14116-14121.
-
(2002)
Proc Natl Acad Sci USA
, vol.99
, pp. 14116-14121
-
-
Kortemme, T.1
Baker, D.2
-
64
-
-
0033058759
-
H3-rules: identification of CDR-H3 structures in antibodies
-
Shirai H, Kidera A, Nakamura H. H3-rules: identification of CDR-H3 structures in antibodies. FEBS Lett 1999;455:188-197.
-
(1999)
FEBS Lett
, vol.455
, pp. 188-197
-
-
Shirai, H.1
Kidera, A.2
Nakamura, H.3
-
65
-
-
0024844388
-
Conformations of immunoglobulin hypervariable regions
-
Chothia C, Lesk A, Tramontano A. Conformations of immunoglobulin hypervariable regions. Nature 1989.
-
(1989)
Nature
-
-
Chothia, C.1
Lesk, A.2
Tramontano, A.3
-
66
-
-
79953815754
-
Bcl:: Cluster: a method for clustering biological molecules coupled with visualization in the Pymol Molecular Graphics System
-
2011 IEEE 1st Int. Conf.
-
Alexander N, Woetzel N, Meiler J. Bcl:: Cluster: a method for clustering biological molecules coupled with visualization in the Pymol Molecular Graphics System. Comput Adv Biol Med Sci (ICCABS), 2011 IEEE 1st Int. Conf. 2011;13-18.
-
(2011)
Comput Adv Biol Med Sci (ICCABS)
, pp. 13-18
-
-
Alexander, N.1
Woetzel, N.2
Meiler, J.3
-
67
-
-
62649147821
-
Sequence context-specific profiles for homology searching
-
Biegert A, Söding J. Sequence context-specific profiles for homology searching. Proc Natl Acad Sci USA 2009;106:3770-3775.
-
(2009)
Proc Natl Acad Sci USA
, vol.106
, pp. 3770-3775
-
-
Biegert, A.1
Söding, J.2
-
68
-
-
0017411710
-
The protein data bank: a computer-based archival file for macromolecular structures
-
Bernstein FC, Koetzle TF, Williams GJ, Meyer EE, Jr, Brice MD, Rodgers JR, Kennard O, Shimanouchi MT. The protein data bank: a computer-based archival file for macromolecular structures. J Mol Biol 1977;112:535.
-
(1977)
J Mol Biol
, vol.112
, pp. 535
-
-
Bernstein, F.C.1
Koetzle, T.F.2
Williams, G.J.3
Meyer, E.E.4
Brice, M.D.5
Rodgers, J.R.6
Kennard, O.7
Shimanouchi, M.T.8
-
69
-
-
84914127473
-
"fuzzy"-logic language for encoding multiple physical traits in biomolecules
-
Warszawski S, Netzer R, Tawfik DS, Fleishman SJ. A "fuzzy"-logic language for encoding multiple physical traits in biomolecules. J Mol Biol 2014;426:4125-4138.
-
(2014)
J Mol Biol
, vol.426
, pp. 4125-4138
-
-
Warszawski, S.1
Netzer, R.2
Tawfik, D.S.3
Fleishman, S.A.4
-
70
-
-
34047232678
-
Positive and negative design in stability and thermal adaptation of natural proteins
-
Berezovsky IN, Zeldovich KB, Shakhnovich EI. Positive and negative design in stability and thermal adaptation of natural proteins. PLoS Comput Biol 2007;3:e52.
-
(2007)
PLoS Comput Biol
, vol.3
, pp. e52
-
-
Berezovsky, I.N.1
Zeldovich, K.B.2
Shakhnovich, E.I.3
-
71
-
-
74049108922
-
BLAST+: architecture and applications
-
Camacho C, Coulouris G, Avagyan V, Ma N, Papadopoulos J, Bealer K, Madden TL. BLAST+: architecture and applications. BMC Bioinform 2009;10:421.
-
(2009)
BMC Bioinform
, vol.10
, pp. 421
-
-
Camacho, C.1
Coulouris, G.2
Avagyan, V.3
Ma, N.4
Papadopoulos, J.5
Bealer, K.6
Madden, T.L.7
-
72
-
-
68349104348
-
Sub-angstrom accuracy in protein loop reconstruction by robotics-inspired conformational sampling
-
Mandell D, Coutsias E, Kortemme T. Sub-angstrom accuracy in protein loop reconstruction by robotics-inspired conformational sampling. Nat Methods 2009;6:551-552.
-
(2009)
Nat Methods
, vol.6
, pp. 551-552
-
-
Mandell, D.1
Coutsias, E.2
Kortemme, T.3
-
73
-
-
45649084560
-
Backrub-like backbone simulation recapitulates natural protein conformational variability and improves mutant side-chain prediction
-
Smith CA, Kortemme T. Backrub-like backbone simulation recapitulates natural protein conformational variability and improves mutant side-chain prediction. J Mol Biol 2008;380:742-756.
-
(2008)
J Mol Biol
, vol.380
, pp. 742-756
-
-
Smith, C.A.1
Kortemme, T.2
-
74
-
-
0037406075
-
Cyclic coordinate descent: a robotics algorithm for protein loop closure
-
Canutescu AA, Jr, Dunbrack RL. Cyclic coordinate descent: a robotics algorithm for protein loop closure. Protein Sci 2003;12:963-972.
-
(2003)
Protein Sci
, vol.12
, pp. 963-972
-
-
Canutescu, A.A.1
Dunbrack, R.L.2
-
75
-
-
78650918983
-
Alternate states of proteins revealed by detailed energy landscape mapping
-
Tyka MD, Keedy DA, André I, DiMaio F, Song Y, Richardson DC, Richardson JS, Baker D. Alternate states of proteins revealed by detailed energy landscape mapping. J Mol Biol 2011;405:607-618.
-
(2011)
J Mol Biol
, vol.405
, pp. 607-618
-
-
Tyka, M.D.1
Keedy, D.A.2
André, I.3
DiMaio, F.4
Song, Y.5
Richardson, D.C.6
Richardson, J.S.7
Baker, D.8
-
77
-
-
84867053249
-
Computational design of catalytic dyads and oxyanion holes for ester hydrolysis
-
Richter F, Blomberg R, Khare SD, Kiss G, Kuzin AP, Smith AJT, Gallaher J, Pianowski Z, Helgeson RC, Grjasnow A, Xiao R, Seetharaman J, Su M, Vorobiev S, Lew S, Forouhar F, Kornhaber GJ, Hunt JF, Montelione GT, Tong L, Houk KN, Hilvert D, Baker D. Computational design of catalytic dyads and oxyanion holes for ester hydrolysis. J Am Chem Soc 2012;134:16197-16206.
-
(2012)
J Am Chem Soc
, vol.134
, pp. 16197-16206
-
-
Richter, F.1
Blomberg, R.2
Khare, S.D.3
Kiss, G.4
Kuzin, A.P.5
Smith, A.J.T.6
Gallaher, J.7
Pianowski, Z.8
Helgeson, R.C.9
Grjasnow, A.10
Xiao, R.11
Seetharaman, J.12
Su, M.13
Vorobiev, S.14
Lew, S.15
Forouhar, F.16
Kornhaber, G.J.17
Hunt, J.F.18
Montelione, G.T.19
Tong, L.20
Houk, K.N.21
Hilvert, D.22
Baker, D.23
more..
-
78
-
-
4744369286
-
Substantial energetic improvement with minimal structural perturbation in a high affinity mutant antibody
-
Midelfort KS, Hernandez HH, Lippow SM, Tidor B, Drennan CL, Wittrup KD. Substantial energetic improvement with minimal structural perturbation in a high affinity mutant antibody. J Mol Biol 2004;343:685-701.
-
(2004)
J Mol Biol
, vol.343
, pp. 685-701
-
-
Midelfort, K.S.1
Hernandez, H.H.2
Lippow, S.M.3
Tidor, B.4
Drennan, C.L.5
Wittrup, K.D.6
-
79
-
-
84891771647
-
SAbDab: the structural antibody database
-
Dunbar J, Krawczyk K, Leem J, Baker T, Fuchs A, Georges G, Shi J, Deane CM. SAbDab: the structural antibody database. Nucleic Acids Res 2014;42:D1140-D1146.
-
(2014)
Nucleic Acids Res
, vol.42
, pp. D1140-D1146
-
-
Dunbar, J.1
Krawczyk, K.2
Leem, J.3
Baker, T.4
Fuchs, A.5
Georges, G.6
Shi, J.7
Deane, C.M.8
-
80
-
-
0017614064
-
Structural basis for the specificity of antibody-antigen reactions and structural mechanisms for the diversification of antigen-binding specificities
-
Padlan EA. Structural basis for the specificity of antibody-antigen reactions and structural mechanisms for the diversification of antigen-binding specificities. Q Rev Biophys 1977;10:35-65.
-
(1977)
Q Rev Biophys
, vol.10
, pp. 35-65
-
-
Padlan, E.A.1
-
81
-
-
0027253021
-
Optimal humanization of 1B4, an anti-CD18 murine monoclonal antibody, is achieved by correct choice of human V-region framework sequences
-
Singer I, et al. Optimal humanization of 1B4, an anti-CD18 murine monoclonal antibody, is achieved by correct choice of human V-region framework sequences. J Immunol 1993;150:2844-2857.
-
(1993)
J Immunol
, vol.150
, pp. 2844-2857
-
-
Singer, I.1
-
82
-
-
0025848797
-
A possible procedure for reducing the immunogenicity of antibody variable domains while preserving their ligand-binding properties
-
Padlan E. A possible procedure for reducing the immunogenicity of antibody variable domains while preserving their ligand-binding properties. Mol Immunol 1991;28:489-498.
-
(1991)
Mol Immunol
, vol.28
, pp. 489-498
-
-
Padlan, E.1
-
83
-
-
0025063143
-
Framework residue 71 is a major determinant of the position and conformation of the second hypervariable region in the VH domains of immunoglobulins
-
Tramontano A, Chothia C, Lesk AM. Framework residue 71 is a major determinant of the position and conformation of the second hypervariable region in the VH domains of immunoglobulins. J Mol Biol 1990;215:175-182.
-
(1990)
J Mol Biol
, vol.215
, pp. 175-182
-
-
Tramontano, A.1
Chothia, C.2
Lesk, A.M.3
-
84
-
-
0026559783
-
Antibody framework residues affecting the conformation of the hypervariable loops
-
Foote J, Winter G. Antibody framework residues affecting the conformation of the hypervariable loops. J Mol Biol 1992;224:487-499.
-
(1992)
J Mol Biol
, vol.224
, pp. 487-499
-
-
Foote, J.1
Winter, G.2
-
85
-
-
0030577371
-
Structural classification of CDR-H3 in antibodies
-
Shirai H, Kidera A, Nakamura H. Structural classification of CDR-H3 in antibodies. FEBS Lett 1996;399:1-8.
-
(1996)
FEBS Lett
, vol.399
, pp. 1-8
-
-
Shirai, H.1
Kidera, A.2
Nakamura, H.3
-
86
-
-
79961012919
-
Benchmarking and analysis of protein docking performance in rosetta v3.2
-
Chaudhury S, Berrondo M, Weitzner BD, Muthu P, Bergman H, Gray JJ. Benchmarking and analysis of protein docking performance in rosetta v3.2. PLoS One 2011;6:e22477.
-
(2011)
PLoS One
, vol.6
, pp. e22477
-
-
Chaudhury, S.1
Berrondo, M.2
Weitzner, B.D.3
Muthu, P.4
Bergman, H.5
Gray, J.J.6
-
87
-
-
84894929772
-
Computational design of protein-small molecule interfaces
-
Allison B, et al. Computational design of protein-small molecule interfaces. J Struct Biol 2014;185:193-202.
-
(2014)
J Struct Biol
, vol.185
, pp. 193-202
-
-
Allison, B.1
-
88
-
-
84863774072
-
Broadly neutralizing antibodies present new prospects to counter highly antigenically diverse viruses
-
Burton DR, Poignard P, Stanfield RL, Wilson IA. Broadly neutralizing antibodies present new prospects to counter highly antigenically diverse viruses. Science 2012;337:183-186.
-
(2012)
Science
, vol.337
, pp. 183-186
-
-
Burton, D.R.1
Poignard, P.2
Stanfield, R.L.3
Wilson, I.A.4
-
90
-
-
77954811495
-
Computational design of an enzyme catalyst for a stereoselective bimolecular Diels-alder reaction
-
Siegel JB, Zanghellini A, Lovick HM, Kiss G, Lambert AR, St Clair JL, Gallaher JL, Hilvert D, Gelb MH, Stoddard BL, Houk KN, Michael FE, Baker D. Computational design of an enzyme catalyst for a stereoselective bimolecular Diels-alder reaction. Science 2010;329:309-313.
-
(2010)
Science
, vol.329
, pp. 309-313
-
-
Siegel, J.B.1
Zanghellini, A.2
Lovick, H.M.3
Kiss, G.4
Lambert, A.R.5
St Clair, J.L.6
Gallaher, J.L.7
Hilvert, D.8
Gelb, M.H.9
Stoddard, B.L.10
Houk, K.N.11
Michael, F.E.12
Baker, D.13
-
91
-
-
84884166196
-
Computational design of ligand-binding proteins with high affinity and selectivity
-
Tinberg CE, Khare SD, Dou J, Doyle L, Nelson JW, Schena A, Jankowski W, Kalodimos CG, Johnsson K, Stoddard BL, Baker D. Computational design of ligand-binding proteins with high affinity and selectivity. Nature 2013;501:212-216.
-
(2013)
Nature
, vol.501
, pp. 212-216
-
-
Tinberg, C.E.1
Khare, S.D.2
Dou, J.3
Doyle, L.4
Nelson, J.W.5
Schena, A.6
Jankowski, W.7
Kalodimos, C.G.8
Johnsson, K.9
Stoddard, B.L.10
Baker, D.11
-
92
-
-
71049189254
-
Unraveling the allosteric mechanism of serine protease inhibition by an antibody
-
Ganesan R, Eigenbrot C, Wu Y, Liang W-C, Shia S, Lipari MT, Kirchhofer D. Unraveling the allosteric mechanism of serine protease inhibition by an antibody. Structure 2009;17:1614-1624.
-
(2009)
Structure
, vol.17
, pp. 1614-1624
-
-
Ganesan, R.1
Eigenbrot, C.2
Wu, Y.3
Liang, W.-C.4
Shia, S.5
Lipari, M.T.6
Kirchhofer, D.7
-
93
-
-
33746810900
-
Structural basis for HIV-1 neutralization by a gp41 fusion intermediate-directed antibody
-
Luftig MA, Mattu M, Di Giovine P, Geleziunas R, Hrin R, Barbato G, Bianchi E, Miller MD, Pessi A, Carfi A. Structural basis for HIV-1 neutralization by a gp41 fusion intermediate-directed antibody. Nat Struct Mol Biol 2006;13:740-747.
-
(2006)
Nat Struct Mol Biol
, vol.13
, pp. 740-747
-
-
Luftig, M.A.1
Mattu, M.2
Di Giovine, P.3
Geleziunas, R.4
Hrin, R.5
Barbato, G.6
Bianchi, E.7
Miller, M.D.8
Pessi, A.9
Carfi, A.10
-
94
-
-
0035412387
-
Structure of a factor VIII C2 domain-immunoglobulin G4kappa fab complex: identification of an inhibitory antibody epitope on the surface of factor VIII
-
Spiegel PC. Structure of a factor VIII C2 domain-immunoglobulin G4kappa fab complex: identification of an inhibitory antibody epitope on the surface of factor VIII. Blood 2001;98:13-19.
-
(2001)
Blood
, vol.98
, pp. 13-19
-
-
Spiegel, P.C.1
-
95
-
-
0032516765
-
Structural basis for the binding of an anti-cytochrome c antibody to its antigen: crystal structures of FabE8-cytochrome c complex to 1.8 a resolution and FabE8 to 2.26 a resolution
-
Mylvaganam SE, Paterson Y, Getzoff ED. Structural basis for the binding of an anti-cytochrome c antibody to its antigen: crystal structures of FabE8-cytochrome c complex to 1.8 a resolution and FabE8 to 2.26 a resolution. J Mol Biol 1998;281:301-322.
-
(1998)
J Mol Biol
, vol.281
, pp. 301-322
-
-
Mylvaganam, S.E.1
Paterson, Y.2
Getzoff, E.D.3
-
96
-
-
0028014642
-
Bound water molecules and conformational stabilization help mediate an antigen-antibody association
-
Bhat TN, Bentley GA, Boulot G, Greene MI, Tello D, Dall'Acqua W, Souchon H, Schwarz FP, Mariuzza RA, Poljak RJ. Bound water molecules and conformational stabilization help mediate an antigen-antibody association. Proc Natl Acad Sci USA 1994;91:1089-1093.
-
(1994)
Proc Natl Acad Sci USA
, vol.91
, pp. 1089-1093
-
-
Bhat, T.N.1
Bentley, G.A.2
Boulot, G.3
Greene, M.I.4
Tello, D.5
Dall'Acqua, W.6
Souchon, H.7
Schwarz, F.P.8
Mariuzza, R.A.9
Poljak, R.J.10
-
97
-
-
1542408991
-
Structural mechanism for affinity maturation of an anti-lysozyme antibody
-
Cauerhff A, Goldbaum FA, Braden BC. Structural mechanism for affinity maturation of an anti-lysozyme antibody. Proc Natl Acad Sci USA 2004;101:3539-3544.
-
(2004)
Proc Natl Acad Sci USA
, vol.101
, pp. 3539-3544
-
-
Cauerhff, A.1
Goldbaum, F.A.2
Braden, B.C.3
-
98
-
-
0032584379
-
The 2.5 a resolution structure of the jel42 fab fragment/HPr complex
-
Prasad L, Waygood EB, Lee JS, Delbaere LT. The 2.5 a resolution structure of the jel42 fab fragment/HPr complex. J Mol Biol 1998;280:829-845.
-
(1998)
J Mol Biol
, vol.280
, pp. 829-845
-
-
Prasad, L.1
Waygood, E.B.2
Lee, J.S.3
Delbaere, L.T.4
-
99
-
-
77955953035
-
Hedgehog pathway antagonist 5E1 binds hedgehog at the pseudo-active site
-
Maun HR, Wen X, Lingel A, de Sauvage FJ, a Lazarus R, Scales SJ, Hymowitz SG. Hedgehog pathway antagonist 5E1 binds hedgehog at the pseudo-active site. J Biol Chem 2010;285:26570-26580.
-
(2010)
J Biol Chem
, vol.285
, pp. 26570-26580
-
-
Maun, H.R.1
Wen, X.2
Lingel, A.3
de Sauvage, F.J.4
a Lazarus, R.5
Scales, S.J.6
Hymowitz, S.G.7
-
100
-
-
0035850666
-
The 1.85 a resolution crystal structures of tissue factor in complex with humanized fab D3h44 and of free humanized fab D3h44: revisiting the solvation of antigen combining sites
-
Faelber K, Kirchhofer D, Presta L, Kelley RF, Muller YA. The 1.85 a resolution crystal structures of tissue factor in complex with humanized fab D3h44 and of free humanized fab D3h44: revisiting the solvation of antigen combining sites. J Mol Biol 2001;313:83-97.
-
(2001)
J Mol Biol
, vol.313
, pp. 83-97
-
-
Faelber, K.1
Kirchhofer, D.2
Presta, L.3
Kelley, R.F.4
Muller, Y.A.5
-
101
-
-
0034641749
-
Native protein sequences are close to optimal for their structures
-
Kuhlman B, Baker D. Native protein sequences are close to optimal for their structures. Proc Natl Acad Sci USA 2000;97:10383-10388.
-
(2000)
Proc Natl Acad Sci USA
, vol.97
, pp. 10383-10388
-
-
Kuhlman, B.1
Baker, D.2
-
102
-
-
0028429178
-
Conformational analysis of the backbone-dependent rotamer preferences of protein sidechains
-
Dunbrack RL, Karplus M. Conformational analysis of the backbone-dependent rotamer preferences of protein sidechains. Nat Struct Mol Biol 1994;1:334-340.
-
(1994)
Nat Struct Mol Biol
, vol.1
, pp. 334-340
-
-
Dunbrack, R.L.1
Karplus, M.2
-
103
-
-
0035845637
-
A comparative analysis of the immunological evolution of antibody 28B4
-
Yin J, et al. A comparative analysis of the immunological evolution of antibody 28B4. Biochemistry 2001;40:10764-10773.
-
(2001)
Biochemistry
, vol.40
, pp. 10764-10773
-
-
Yin, J.1
-
104
-
-
0037373997
-
Thermodynamic and kinetic aspects of antibody evolution during the immune response to hapten
-
Sagawa T, Oda M, Ishimura M, Furukawa K, Azuma T. Thermodynamic and kinetic aspects of antibody evolution during the immune response to hapten. Mol Immunol 2003;39:801-808.
-
(2003)
Mol Immunol
, vol.39
, pp. 801-808
-
-
Sagawa, T.1
Oda, M.2
Ishimura, M.3
Furukawa, K.4
Azuma, T.5
-
105
-
-
0033634681
-
Maturation of an antibody response is governed by modulations in flexibility of the antigen-combining site
-
Manivel V, Sahoo NC, Salunke DM, Rao KV. Maturation of an antibody response is governed by modulations in flexibility of the antigen-combining site. Immunity 2000;13:611-620.
-
(2000)
Immunity
, vol.13
, pp. 611-620
-
-
Manivel, V.1
Sahoo, N.C.2
Salunke, D.M.3
Rao, K.V.4
-
106
-
-
0042744723
-
Structural plasticity and the evolution of antibody affinity and specificity
-
Yin J, Beuscher AE, Andryski SE, Stevens RC, Schultz PG. Structural plasticity and the evolution of antibody affinity and specificity. J Mol Biol 2003;330:651-656.
-
(2003)
J Mol Biol
, vol.330
, pp. 651-656
-
-
Yin, J.1
Beuscher, A.E.2
Andryski, S.E.3
Stevens, R.C.4
Schultz, P.G.5
-
107
-
-
84903142850
-
A computationally designed inhibitor of an Epstein-Barr viral Bcl-2 protein induces apoptosis in infected cells
-
Procko E, Berguig GY, Shen BW, Song Y, Frayo S, Convertine AJ, Margineantu D, Booth G, Correia BE, Cheng Y, Schief WR, Hockenbery DM, Press OW, Stoddard BL, Stayton PS, Baker D. A computationally designed inhibitor of an Epstein-Barr viral Bcl-2 protein induces apoptosis in infected cells. Cell 2014;157:1644-1656.
-
(2014)
Cell
, vol.157
, pp. 1644-1656
-
-
Procko, E.1
Berguig, G.Y.2
Shen, B.W.3
Song, Y.4
Frayo, S.5
Convertine, A.J.6
Margineantu, D.7
Booth, G.8
Correia, B.E.9
Cheng, Y.10
Schief, W.R.11
Hockenbery, D.M.12
Press, O.W.13
Stoddard, B.L.14
Stayton, P.S.15
Baker, D.16
-
108
-
-
70350334391
-
Computer-aided design of functional protein interactions
-
Mandell DJ, Kortemme T. Computer-aided design of functional protein interactions. Nat Chem Biol 2009;5:797-807.
-
(2009)
Nat Chem Biol
, vol.5
, pp. 797-807
-
-
Mandell, D.J.1
Kortemme, T.2
-
109
-
-
0026094165
-
Humanization of a mouse monoclonal antibody by CDR-grafting: The importance of framework residues on loop conformation
-
Kettleborough CA, Saldanha J, Heath VJ, Morrison CJ, Bendig MM. Humanization of a mouse monoclonal antibody by CDR-grafting: The importance of framework residues on loop conformation. Protein Eng 1991;4:773-783.
-
(1991)
Protein Eng
, vol.4
, pp. 773-783
-
-
Kettleborough, C.A.1
Saldanha, J.2
Heath, V.J.3
Morrison, C.J.4
Bendig, M.M.5
-
110
-
-
0036785591
-
How do two unrelated antibodies, HyHEL-10 and F9.13.7, recognize the same epitope of hen egg-white lysozyme?
-
Pons J, Stratton JR, Kirsch JF. How do two unrelated antibodies, HyHEL-10 and F9.13.7, recognize the same epitope of hen egg-white lysozyme? Protein Sci 2002;11:2308-2315.
-
(2002)
Protein Sci
, vol.11
, pp. 2308-2315
-
-
Pons, J.1
Stratton, J.R.2
Kirsch, J.F.3
-
111
-
-
84878306995
-
Protein-protein interactions: general trends in the relationship between binding affinity and interfacial buried surface area
-
Chen J, Sawyer N, Regan L. Protein-protein interactions: general trends in the relationship between binding affinity and interfacial buried surface area. Protein Sci 2013;22:510-515.
-
(2013)
Protein Sci
, vol.22
, pp. 510-515
-
-
Chen, J.1
Sawyer, N.2
Regan, L.3
-
112
-
-
84874027181
-
-
Leaver-Fay A, O'Meara MJ, Tyka M, Jacak R, Song Y, Kellogg EH, Thompson J, Davis IW, a Pache R, Lyskov S, Gray JJ, Kortemme T, Richardson JS, Havranek JJ, Snoeyink J, Baker D, Kuhlman B. Scientific benchmarks for guiding macromolecular energy function improvement. Vol. 523; 2013. pp. 109-143.
-
(2013)
Scientific benchmarks for guiding macromolecular energy function improvement
, vol.523
, pp. 109-143
-
-
Leaver-Fay, A.1
O'Meara, M.J.2
Tyka, M.3
Jacak, R.4
Song, Y.5
Kellogg, E.H.6
Thompson, J.7
Davis, I.W.8
a Pache, R.9
Lyskov, S.10
Gray, J.J.11
Kortemme, T.12
Richardson, J.S.13
Havranek, J.J.14
Snoeyink, J.15
Baker, D.16
Kuhlman, B.17
-
113
-
-
79955721644
-
Structure-guided forcefield optimization
-
Song Y, Tyka M, Leaver-Fay A, Thompson J, Baker D. Structure-guided forcefield optimization. Proteins 2011;79:1898-1909.
-
(2011)
Proteins
, vol.79
, pp. 1898-1909
-
-
Song, Y.1
Tyka, M.2
Leaver-Fay, A.3
Thompson, J.4
Baker, D.5
|