-
1
-
-
0024972479
-
Capping and α-helix stability
-
Serrano L., and Fersht A.R. Capping and α-helix stability. Nature 342 (1989) 296-299
-
(1989)
Nature
, vol.342
, pp. 296-299
-
-
Serrano, L.1
Fersht, A.R.2
-
2
-
-
0035106699
-
Effect of the N1 residue on the stability of the α-helix for all 20 amino acids
-
Cochran D.A.E., Penel S., and Doig A.J. Effect of the N1 residue on the stability of the α-helix for all 20 amino acids. Protein Sci. 10 (2001) 463-470
-
(2001)
Protein Sci.
, vol.10
, pp. 463-470
-
-
Cochran, D.A.E.1
Penel, S.2
Doig, A.J.3
-
3
-
-
0031455857
-
β-Hairpins in proteins revisited: lessons for de novo design
-
Gunasekaran K., Ramakrishnan C., and Balaram P. β-Hairpins in proteins revisited: lessons for de novo design. Protein Eng. 10 (1997) 1131-1141
-
(1997)
Protein Eng.
, vol.10
, pp. 1131-1141
-
-
Gunasekaran, K.1
Ramakrishnan, C.2
Balaram, P.3
-
4
-
-
0026665778
-
Side-chain entropy opposes alpha-helix formation but rationalizes experimentally determined helix-forming propensities
-
Creamer T.P., and Rose G.D. Side-chain entropy opposes alpha-helix formation but rationalizes experimentally determined helix-forming propensities. Proc. Natl. Acad. Sci. U.S.A. 89 (1992) 5937-5941
-
(1992)
Proc. Natl. Acad. Sci. U.S.A.
, vol.89
, pp. 5937-5941
-
-
Creamer, T.P.1
Rose, G.D.2
-
5
-
-
0028173780
-
Rules for alpha-helix termination by glycine
-
Aurora R., Srinivasan R., and Rose G.D. Rules for alpha-helix termination by glycine. Science 264 (1994) 1126-1130
-
(1994)
Science
, vol.264
, pp. 1126-1130
-
-
Aurora, R.1
Srinivasan, R.2
Rose, G.D.3
-
6
-
-
0034994293
-
The interrelationships of side-chain and main-chain conformations in proteins
-
Chakrabarti P., and Pal D. The interrelationships of side-chain and main-chain conformations in proteins. Prog. Biophys. Mol. Biol. 76 (2001) 1-102
-
(2001)
Prog. Biophys. Mol. Biol.
, vol.76
, pp. 1-102
-
-
Chakrabarti, P.1
Pal, D.2
-
7
-
-
0036113724
-
Analysis of the factors that stabilize a designed two stranded antiparallel β-sheet
-
Espinosa J.F., Syud F.A., and Gellman S.H. Analysis of the factors that stabilize a designed two stranded antiparallel β-sheet. Protein Sci. 11 (2002) 1492-1505
-
(2002)
Protein Sci.
, vol.11
, pp. 1492-1505
-
-
Espinosa, J.F.1
Syud, F.A.2
Gellman, S.H.3
-
8
-
-
30344445370
-
Amino acid pairing preferences in parallel β-sheets in proteins
-
Fooks H.M., Martin A.C.R., Woolfson D.N., Sessions R.B., and Hutchinson E.G. Amino acid pairing preferences in parallel β-sheets in proteins. J. Mol. Biol. 356 (2006) 32-44
-
(2006)
J. Mol. Biol.
, vol.356
, pp. 32-44
-
-
Fooks, H.M.1
Martin, A.C.R.2
Woolfson, D.N.3
Sessions, R.B.4
Hutchinson, E.G.5
-
9
-
-
0033571653
-
Sidechain interactions in parallel β-sheets: the energetics of cross-strand pairings
-
Merkel J.S., Sturtevant J.M., and Regan L. Sidechain interactions in parallel β-sheets: the energetics of cross-strand pairings. Structure 7 (1999) 1333-1343
-
(1999)
Structure
, vol.7
, pp. 1333-1343
-
-
Merkel, J.S.1
Sturtevant, J.M.2
Regan, L.3
-
10
-
-
0035795721
-
Amino acid distributions in integral membrane protein structures
-
Ulmschneider M.B., and Sansom M.S.P. Amino acid distributions in integral membrane protein structures. Biochim. Biophys. Acta 1512 (2001) 1-14
-
(2001)
Biochim. Biophys. Acta
, vol.1512
, pp. 1-14
-
-
Ulmschneider, M.B.1
Sansom, M.S.P.2
-
11
-
-
7244262067
-
Mimicry by asx- and ST-turns of the four main types of beta-turn in proteins
-
Duddy W.J., Nissink J.W.M., Allen F.H., and Milner-White E.J. Mimicry by asx- and ST-turns of the four main types of beta-turn in proteins. Protein Sci. 13 (2004) 3051-3055
-
(2004)
Protein Sci.
, vol.13
, pp. 3051-3055
-
-
Duddy, W.J.1
Nissink, J.W.M.2
Allen, F.H.3
Milner-White, E.J.4
-
12
-
-
0033548705
-
A recurring two-hydrogen-bond motif incorporating a serine or threonine residue is found both at α-helical N termini and in other situations
-
Wai-Yan W., and Milner-White E.J. A recurring two-hydrogen-bond motif incorporating a serine or threonine residue is found both at α-helical N termini and in other situations. J. Mol. Biol. 286 (1999) 1651-1662
-
(1999)
J. Mol. Biol.
, vol.286
, pp. 1651-1662
-
-
Wai-Yan, W.1
Milner-White, E.J.2
-
14
-
-
0034062925
-
Deterministic features of side-chain main-chain hydrogen bonds in globular protein structures
-
Eswar N., and Ramakrishnan C. Deterministic features of side-chain main-chain hydrogen bonds in globular protein structures. Protein Eng. 13 (2000) 227-238
-
(2000)
Protein Eng.
, vol.13
, pp. 227-238
-
-
Eswar, N.1
Ramakrishnan, C.2
-
15
-
-
0033548459
-
A natural grouping motif with an aspartate or asparagine residue forming two hydrogen bonds to residues ahead in sequence: their occurrence at α-helical N termini and other situations
-
Wai-Yan W., and Milner-White E.J. A natural grouping motif with an aspartate or asparagine residue forming two hydrogen bonds to residues ahead in sequence: their occurrence at α-helical N termini and other situations. J. Mol. Biol. 286 (1999) 1633-1649
-
(1999)
J. Mol. Biol.
, vol.286
, pp. 1633-1649
-
-
Wai-Yan, W.1
Milner-White, E.J.2
-
16
-
-
0033582944
-
Side-chain structures in the first turn of the α-helix
-
Penel S., Hughes E., and Doig A.J. Side-chain structures in the first turn of the α-helix. J. Mol. Biol. 287 (1999) 127-143
-
(1999)
J. Mol. Biol.
, vol.287
, pp. 127-143
-
-
Penel, S.1
Hughes, E.2
Doig, A.J.3
-
17
-
-
0037880480
-
Close pairs of carboxylates: a possibility of multicenter hydrogen bonds in proteins
-
Torshin I.Y., Harrison R.W., and Weber I.T. Close pairs of carboxylates: a possibility of multicenter hydrogen bonds in proteins. Protein Eng. 16 (2003) 201-207
-
(2003)
Protein Eng.
, vol.16
, pp. 201-207
-
-
Torshin, I.Y.1
Harrison, R.W.2
Weber, I.T.3
-
18
-
-
0033455572
-
Carbonyl-carbonyl interactions stabilize the partially allowed Ramachandran conformations of asparagine and aspartic acid
-
Deane C.M., Allen F.H., Taylor R., and Blundell T.L. Carbonyl-carbonyl interactions stabilize the partially allowed Ramachandran conformations of asparagine and aspartic acid. Protein Eng. 12 (1999) 1025-1028
-
(1999)
Protein Eng.
, vol.12
, pp. 1025-1028
-
-
Deane, C.M.1
Allen, F.H.2
Taylor, R.3
Blundell, T.L.4
-
19
-
-
0037441653
-
Structure validation by Cα geometry: φ{symbol}, ψ and Cβ deviation
-
Lovell S.C., Davis I.W., Arendall III W.B., de Bakker P.I.W., Word J.M., Prisant M.G., Richardson J.S., and Richardson D.C. Structure validation by Cα geometry: φ{symbol}, ψ and Cβ deviation. Proteins: Struct. Funct. Genet. 50 (2003) 437-450
-
(2003)
Proteins: Struct. Funct. Genet.
, vol.50
, pp. 437-450
-
-
Lovell, S.C.1
Davis, I.W.2
Arendall III, W.B.3
de Bakker, P.I.W.4
Word, J.M.5
Prisant, M.G.6
Richardson, J.S.7
Richardson, D.C.8
-
21
-
-
0028205447
-
Enlarged representative set of protein structures
-
Hobohm U., and Sander C. Enlarged representative set of protein structures. Protein Sci. 3 (1994) 522-524
-
(1994)
Protein Sci.
, vol.3
, pp. 522-524
-
-
Hobohm, U.1
Sander, C.2
-
22
-
-
0033954256
-
The Protein Data Bank
-
Berman H.M., Westbrook J., Feng Z., Gilliand G., Bhat T.N., Weissig H., Shindyalov I.N., and Bourne P.E. The Protein Data Bank. Nucleic Acids Res. 28 (2000) 235-242
-
(2000)
Nucleic Acids Res.
, vol.28
, pp. 235-242
-
-
Berman, H.M.1
Westbrook, J.2
Feng, Z.3
Gilliand, G.4
Bhat, T.N.5
Weissig, H.6
Shindyalov, I.N.7
Bourne, P.E.8
-
23
-
-
0033613812
-
Visualizing and quantifying molecular goodness-of-fit: small-probe contact dots with explicit hydrogen atoms
-
Word J.M., Lovell S.C., LaBean T.H., Taylor H.C., Zalis M.E., Presley B.K., Richardson J.S., and Richardson D.C. Visualizing and quantifying molecular goodness-of-fit: small-probe contact dots with explicit hydrogen atoms. J. Mol. Biol. 285 (1999) 1711-1733
-
(1999)
J. Mol. Biol.
, vol.285
, pp. 1711-1733
-
-
Word, J.M.1
Lovell, S.C.2
LaBean, T.H.3
Taylor, H.C.4
Zalis, M.E.5
Presley, B.K.6
Richardson, J.S.7
Richardson, D.C.8
-
24
-
-
0033614004
-
Asparagine and glutamine: using hydrogen atom contacts in the choice of side-chain amide orientation
-
Word J.M., Lovell S.C., Richardson J.S., and Richardson D.C. Asparagine and glutamine: using hydrogen atom contacts in the choice of side-chain amide orientation. J. Mol. Biol. 285 (1999) 1735-1747
-
(1999)
J. Mol. Biol.
, vol.285
, pp. 1735-1747
-
-
Word, J.M.1
Lovell, S.C.2
Richardson, J.S.3
Richardson, D.C.4
-
26
-
-
33744827382
-
Self-consistent assignment of asparagine and glutamine amide rotamers in protein crystal structures
-
Weichenberger C.X., and Sippl M.J. Self-consistent assignment of asparagine and glutamine amide rotamers in protein crystal structures. Structure 14 (2006) 967-972
-
(2006)
Structure
, vol.14
, pp. 967-972
-
-
Weichenberger, C.X.1
Sippl, M.J.2
-
27
-
-
0029017638
-
The application of hydrogen bonding analysis in X-ray crystallography to help orient asparagine, glutamine and histidine side chains
-
McDonald I.K., and Thornton J.M. The application of hydrogen bonding analysis in X-ray crystallography to help orient asparagine, glutamine and histidine side chains. Protein Eng. 8 (1994) 217-224
-
(1994)
Protein Eng.
, vol.8
, pp. 217-224
-
-
McDonald, I.K.1
Thornton, J.M.2
-
28
-
-
33745599120
-
NQ-Flipper: validation and correction of asparagine/glutamine amide rotamers in protein crystal structures
-
Weichenberger C.X., and Sippl M.J. NQ-Flipper: validation and correction of asparagine/glutamine amide rotamers in protein crystal structures. Bioinformatics 22 (2006) 1397-1398
-
(2006)
Bioinformatics
, vol.22
, pp. 1397-1398
-
-
Weichenberger, C.X.1
Sippl, M.J.2
-
29
-
-
0028304962
-
Satisfying hydrogen bonding potential in proteins
-
McDonald I.K., and Thornton J.M. Satisfying hydrogen bonding potential in proteins. J. Mol. Biol. 238 (1994) 777-793
-
(1994)
J. Mol. Biol.
, vol.238
, pp. 777-793
-
-
McDonald, I.K.1
Thornton, J.M.2
-
30
-
-
2342593131
-
Close agreement between the orientation dependence of hydrogen bonds observed in protein structures and quantum mechanical calculations
-
Morozov A.V., Kortemme T., Tsemekhman K., and Baker D. Close agreement between the orientation dependence of hydrogen bonds observed in protein structures and quantum mechanical calculations. Proc. Natl. Acad. Sci. U.S.A. 101 (2004) 6946-6951
-
(2004)
Proc. Natl. Acad. Sci. U.S.A.
, vol.101
, pp. 6946-6951
-
-
Morozov, A.V.1
Kortemme, T.2
Tsemekhman, K.3
Baker, D.4
-
31
-
-
17444404162
-
Short hydrogen bonds in proteins
-
Rajagopal S., and Vishveshwara S. Short hydrogen bonds in proteins. FEBS J. 272 (2005) 1819-1832
-
(2005)
FEBS J.
, vol.272
, pp. 1819-1832
-
-
Rajagopal, S.1
Vishveshwara, S.2
-
32
-
-
49649107197
-
-
S.J. Hubbard, J.M. Thronton, 'NACCESS', Computer program, Department of Biochemistry and Molecular Biology, UCL (1993).
-
S.J. Hubbard, J.M. Thronton, 'NACCESS', Computer program, Department of Biochemistry and Molecular Biology, UCL (1993).
-
-
-
-
33
-
-
0015222647
-
The interpretation of protein structures: estimation of static accessibility
-
Lee B., and Richards F.M. The interpretation of protein structures: estimation of static accessibility. J. Mol. Biol. 55 (1971) 379-400
-
(1971)
J. Mol. Biol.
, vol.55
, pp. 379-400
-
-
Lee, B.1
Richards, F.M.2
-
34
-
-
0017187836
-
The nature of accessible and buried surfaces in proteins
-
Chothia C. The nature of accessible and buried surfaces in proteins. J. Mol. Biol. 105 (1976) 1-14
-
(1976)
J. Mol. Biol.
, vol.105
, pp. 1-14
-
-
Chothia, C.1
-
35
-
-
0016606973
-
Structural invariants in protein folding
-
Chothia C. Structural invariants in protein folding. Nature 254 (1975) 304-308
-
(1975)
Nature
, vol.254
, pp. 304-308
-
-
Chothia, C.1
-
36
-
-
0020997912
-
Dictionary of protein secondary structure: pattern recognition of hydrogen-bonded and geometrical features
-
Kabsch W., and Sander C. Dictionary of protein secondary structure: pattern recognition of hydrogen-bonded and geometrical features. Biopolymers 22 (1983) 2577-2637
-
(1983)
Biopolymers
, vol.22
, pp. 2577-2637
-
-
Kabsch, W.1
Sander, C.2
-
38
-
-
0018115846
-
Conformation of amino acid side-chains in proteins
-
Janin J., Wodak S., Levitt M., and Maigret B. Conformation of amino acid side-chains in proteins. J. Mol. Biol. 125 (1978) 357-386
-
(1978)
J. Mol. Biol.
, vol.125
, pp. 357-386
-
-
Janin, J.1
Wodak, S.2
Levitt, M.3
Maigret, B.4
-
41
-
-
0029048210
-
Coulombic interactions between partially charged main-chain atoms not hydrogen-bonded to each other influence the conformations of α-helices and antiparallel β-sheet. A new method for analyzing the forces between hydrogen bonding groups in proteins includes all the Coulombic interactions
-
Maccallum P.H., Poet R., and Milner-White E.J. Coulombic interactions between partially charged main-chain atoms not hydrogen-bonded to each other influence the conformations of α-helices and antiparallel β-sheet. A new method for analyzing the forces between hydrogen bonding groups in proteins includes all the Coulombic interactions. J. Mol. Biol. 248 (1995) 361-373
-
(1995)
J. Mol. Biol.
, vol.248
, pp. 361-373
-
-
Maccallum, P.H.1
Poet, R.2
Milner-White, E.J.3
-
42
-
-
0029078444
-
Coulombic attractions between partially charged main-chain atoms stabilise the right-handed twist found in most β-strands
-
Maccallum P.H., Poet R., and Milner-White E.J. Coulombic attractions between partially charged main-chain atoms stabilise the right-handed twist found in most β-strands. J. Mol. Biol. 248 (1995) 374-384
-
(1995)
J. Mol. Biol.
, vol.248
, pp. 374-384
-
-
Maccallum, P.H.1
Poet, R.2
Milner-White, E.J.3
-
43
-
-
4444221565
-
UCSF Chimera-a visualization system for exploratory research and analysis
-
Pettersen E.F., Goddard T.D., Huang C.C., Couch G.S., Greenblatt D.M., Meng E.C., and Ferrin T.E. UCSF Chimera-a visualization system for exploratory research and analysis. J. Comput. Chem. 25 (2004) 1605-1612
-
(2004)
J. Comput. Chem.
, vol.25
, pp. 1605-1612
-
-
Pettersen, E.F.1
Goddard, T.D.2
Huang, C.C.3
Couch, G.S.4
Greenblatt, D.M.5
Meng, E.C.6
Ferrin, T.E.7
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