-
1
-
-
0030466444
-
Add Water! The Effect of Water on the Specificity of Protein-Ligand Binding Sites and Its Potential Application to Drug Design
-
Ladury, J. E. Just Add Water! The Effect of Water on the Specificity of Protein-Ligand Binding Sites and Its Potential Application to Drug Design. Chem. Biol. 1996, 3, 973-980.
-
(1996)
Chem. Biol
, vol.3
, pp. 973-980
-
-
Ladury, J.1
Just, E.2
-
2
-
-
0027918556
-
-
Levitt, M.; Park, B. H. Water: Now You See It, Now You Don't. Structure 1993, 1, 223-226.
-
Levitt, M.; Park, B. H. Water: Now You See It, Now You Don't. Structure 1993, 1, 223-226.
-
-
-
-
3
-
-
0033524454
-
Disordered Water within a Hydrophobic Protein Cavity Visualized by X-ray Crystallography
-
Yu, B.; Blaber, M.; Gronenborn, A. M.; Clore, G. M.; Caspar, D. L. D. Disordered Water within a Hydrophobic Protein Cavity Visualized by X-ray Crystallography. Proc. Natl. Acad. Sci. U.S.A. 1999, 96, 103-108.
-
(1999)
Proc. Natl. Acad. Sci. U.S.A
, vol.96
, pp. 103-108
-
-
Yu, B.1
Blaber, M.2
Gronenborn, A.M.3
Clore, G.M.4
Caspar, D.L.D.5
-
4
-
-
0028921999
-
Demonstration of Positionally Disordered Water within a Protein Hydrophobic Cavity by NMR
-
Ernst, J. A.; Clubb, R. T.; Zhou, H. X.; Gronenborn, A. M.; Clore, G. M. Demonstration of Positionally Disordered Water within a Protein Hydrophobic Cavity by NMR. Science 1995, 267, 1813-1817.
-
(1995)
Science
, vol.267
, pp. 1813-1817
-
-
Ernst, J.A.1
Clubb, R.T.2
Zhou, H.X.3
Gronenborn, A.M.4
Clore, G.M.5
-
5
-
-
0030960230
-
Structure-Based Drug Design: Computational Advances
-
Marrone, T. J.; Briggs, J. M.; McCammon, J. A. Structure-Based Drug Design: Computational Advances. Annu. Rev. Pharmacol. Toxicol. 1997, 37, 71-90.
-
(1997)
Annu. Rev. Pharmacol. Toxicol
, vol.37
, pp. 71-90
-
-
Marrone, T.J.1
Briggs, J.M.2
McCammon, J.A.3
-
6
-
-
0028057975
-
Rational Design of Potent, Bioavailable, Nonpeptide Cyclic Areas as HIV Protease Iinhibitors
-
Lam, P. Y. S.; Jadhav, P. K.; Eyermann, C. J.; Hodge, C. N.; Ru, Y.; Bacheler, L. T.; Meek, J. L.; Otto, M. J.; Rayner, M. M.; Wong, Y. N.; Chang, C. H.; Weber, P. C.; Jackson, D. A.; Sharpe, T. R.; Ericksonviitanen, S. Rational Design of Potent, Bioavailable, Nonpeptide Cyclic Areas as HIV Protease Iinhibitors. Science 1994, 263, 380-384.
-
(1994)
Science
, vol.263
, pp. 380-384
-
-
Lam, P.Y.S.1
Jadhav, P.K.2
Eyermann, C.J.3
Hodge, C.N.4
Ru, Y.5
Bacheler, L.T.6
Meek, J.L.7
Otto, M.J.8
Rayner, M.M.9
Wong, Y.N.10
Chang, C.H.11
Weber, P.C.12
Jackson, D.A.13
Sharpe, T.R.14
Ericksonviitanen, S.15
-
7
-
-
0032558981
-
Structure-Based Design of Potent Inhibitors of Scytalone Dehydratase: Displacement of a Water Molecule From the Active Site
-
Chen, J. M.; Xu, S. L.; Wawrzak, Z.; Basarab, G. S.; Jordan, D. B. Structure-Based Design of Potent Inhibitors of Scytalone Dehydratase: Displacement of a Water Molecule From the Active Site. Biochemistry 1998, 37, 17735-17744.
-
(1998)
Biochemistry
, vol.37
, pp. 17735-17744
-
-
Chen, J.M.1
Xu, S.L.2
Wawrzak, Z.3
Basarab, G.S.4
Jordan, D.B.5
-
8
-
-
0029134561
-
The Role of Water Molecules in the Structure-Based Design of (5-Hydroxynorvaline)-2-cyclosporin: Synthesis, Biological Activity, and Crystallographic Analysis with Cyclophilin A
-
Mikol, V.; Papageorgiou, C.; Borer, X. The Role of Water Molecules in the Structure-Based Design of (5-Hydroxynorvaline)-2-cyclosporin: Synthesis, Biological Activity, and Crystallographic Analysis with Cyclophilin A. J. Med. Chem. 1995, 38, 3361-3367.
-
(1995)
J. Med. Chem
, vol.38
, pp. 3361-3367
-
-
Mikol, V.1
Papageorgiou, C.2
Borer, X.3
-
9
-
-
0033550314
-
Novel aromatic inhibitors of influenza virus neuraminidase make selective interactions with conserved residues and water molecules in the active site
-
Finley, J. B.; Atigadda, V. R.; Duarte, F.; Zhao, J. J.; Brouillette, W. J.; Air, G. M.; Luo, M. Novel aromatic inhibitors of influenza virus neuraminidase make selective interactions with conserved residues and water molecules in the active site. J. Mol Biol. 1999, 293, 1107-1109.
-
(1999)
J. Mol Biol
, vol.293
, pp. 1107-1109
-
-
Finley, J.B.1
Atigadda, V.R.2
Duarte, F.3
Zhao, J.J.4
Brouillette, W.J.5
Air, G.M.6
Luo, M.7
-
10
-
-
0034695423
-
Active site water molecules revealed in the 2.1 Åresolution structure of a site-directed mutant of isocitrate dehydrogenase
-
Cherbavaz, D. B.; Lee, M. E.; Stroud, R.M.; Koschl, D. E. Active site water molecules revealed in the 2.1 Åresolution structure of a site-directed mutant of isocitrate dehydrogenase. J. Mol. Biol. 2000, 295, 377-385.
-
(2000)
J. Mol. Biol
, vol.295
, pp. 377-385
-
-
Cherbavaz, D.B.1
Lee, M.E.2
Stroud, R.M.3
Koschl, D.E.4
-
11
-
-
0035413616
-
Cyclin-dependent kinases
-
Harper, J. W.; Adams, P. D. Cyclin-dependent kinases. Chem. Rev. 2001, 101, 2511-2514.
-
(2001)
Chem. Rev
, vol.101
, pp. 2511-2514
-
-
Harper, J.W.1
Adams, P.D.2
-
12
-
-
0027938209
-
Cyclins and Cancer. H: Cyclin D and CDK Inhibitors Come of Age
-
Hunter, T.; Pines, J. Cyclins and Cancer. H: Cyclin D and CDK Inhibitors Come of Age. Cell 1994, 79, 573-582.
-
(1994)
Cell
, vol.79
, pp. 573-582
-
-
Hunter, T.1
Pines, J.2
-
13
-
-
0026693966
-
Animal Cell Cycles and Their Control
-
Norbury, C.; Nurse, P. Animal Cell Cycles and Their Control. Annu. Rev. Biochem. 1992, 61, 441-470.
-
(1992)
Annu. Rev. Biochem
, vol.61
, pp. 441-470
-
-
Norbury, C.1
Nurse, P.2
-
14
-
-
0029993339
-
Structural basis for specificity and potency of a flavonoid inhibitor of human CDK2, a cell cycle kinase
-
Apr 2, 2735-2740
-
De Azevedo, W. F., Jr.; Mueller-Dieckmann, H. J.; Schulze-Gahmen, U.; Worland, P. J.; Sausville, E.; Kim, S. H. Structural basis for specificity and potency of a flavonoid inhibitor of human CDK2, a cell cycle kinase. Proc. Natl. Acad. Sci. U.S.A. 1996, 93 (7) Apr 2, 2735-2740.
-
(1996)
Proc. Natl. Acad. Sci. U.S.A
, vol.93
, Issue.7
-
-
De Azevedo Jr., W.F.1
Mueller-Dieckmann, H.J.2
Schulze-Gahmen, U.3
Worland, P.J.4
Sausville, E.5
Kim, S.H.6
-
15
-
-
0031028163
-
Inhibition of Cyclin-Dependent Kinases by Purine Analogues: Crystal Structure of Human cdk2 Complexed with Roscovitine
-
De Azevedo, W. F., Jr.; Leclerc, S.; Meijer, L.; Havlicek, L.; Strnad, M.; Kim, S. H. Inhibition of Cyclin-Dependent Kinases by Purine Analogues: Crystal Structure of Human cdk2 Complexed with Roscovitine. Eur. J. Biochem. 1997, 243, 518-526.
-
(1997)
Eur. J. Biochem
, vol.243
, pp. 518-526
-
-
De Azevedo Jr., W.F.1
Leclerc, S.2
Meijer, L.3
Havlicek, L.4
Strnad, M.5
Kim, S.H.6
-
20
-
-
0344823864
-
-
Smith, P. D.; Crocker, S. J.; Jackson-Lewis, V.; Jordan-Sciutto, K. L.; Hayley, S. Proc. Natl. Acad. Sci. U.S.A. 2003, 100, 13650-13655.
-
(2003)
Proc. Natl. Acad. Sci. U.S.A
, vol.100
, pp. 13650-13655
-
-
Smith, P.D.1
Crocker, S.J.2
Jackson-Lewis, V.3
Jordan-Sciutto, K.L.4
Hayley, S.5
-
21
-
-
0036703779
-
-
Bu, B.; Li, J.; Davies, P.; Vincent, I. J. Neurosci. 2002, 22, 6515-6525.
-
(2002)
Neurosci
, vol.22
, pp. 6515-6525
-
-
Bu, B.1
Li, J.2
Davies, P.3
Vincent, I.J.4
-
22
-
-
0141542665
-
-
Wang, J.; Liu, S.; Fu, Y.; Wang, J. H.; Lu, Y. Nat. Neurosci. 2003, 6, 1039-1047.
-
(2003)
Nat. Neurosci
, vol.6
, pp. 1039-1047
-
-
Wang, J.1
Liu, S.2
Fu, Y.3
Wang, J.H.4
Lu, Y.5
-
24
-
-
0038245253
-
-
Huew, A.; Mazitschek, R.; Giannis, A. Angew. Chem., Int. Ed. 2003, 42, 2122-2138.
-
(2003)
Angew. Chem., Int. Ed
, vol.42
, pp. 2122-2138
-
-
Huew, A.1
Mazitschek, R.2
Giannis, A.3
-
25
-
-
0034642532
-
-
Sielecki, M.; Boylan, J. F.; Benfield, P. A.; Trainor, G. L. J. Med. Chem. 2000, 43, 1-18.
-
(2000)
J. Med. Chem
, vol.43
, pp. 1-18
-
-
Sielecki, M.1
Boylan, J.F.2
Benfield, P.A.3
Trainor, G.L.4
-
26
-
-
0036710767
-
-
Knockaert, P.; Greengard, L.; Meijer, L. Trends Pharm. Sci. 2002, 23, 417-425.
-
(2002)
Trends Pharm. Sci
, vol.23
, pp. 417-425
-
-
Knockaert, P.1
Greengard, L.2
Meijer, L.3
-
27
-
-
0036926420
-
-
Lau, L. F.; Seymour, P. A.; Sanner, M. A.; Schachter, J. B. J. Mol. Neurosci. 2002, 19, 267-271.
-
(2002)
J. Mol. Neurosci
, vol.19
, pp. 267-271
-
-
Lau, L.F.1
Seymour, P.A.2
Sanner, M.A.3
Schachter, J.B.4
-
29
-
-
0035808457
-
-
Leclerc, S.; Garnier, M.; Hoessel, R.; Marko, D.; Bibb, J. A.; Snyder, G. L.; Greengard, P.; Biernati, J.; Wui, Y.-Z.; Mandelkowi, E.-M.; Eisenbrand, G.; Meijer, L. J. Biol. Chem. 2001, 276, 251-260.
-
(2001)
J. Biol. Chem
, vol.276
, pp. 251-260
-
-
Leclerc, S.1
Garnier, M.2
Hoessel, R.3
Marko, D.4
Bibb, J.A.5
Snyder, G.L.6
Greengard, P.7
Biernati, J.8
Wui, Y.-Z.9
Mandelkowi, E.-M.10
Eisenbrand, G.11
Meijer, L.12
-
30
-
-
1642323740
-
-
Noble, M. E. M.; Endicott, J. A.; Johnson, L. N. Science 2004, 303, 1800-1805.
-
(2004)
Science
, vol.303
, pp. 1800-1805
-
-
Noble, M.E.M.1
Endicott, J.A.2
Johnson, L.N.3
-
31
-
-
29144520253
-
-
Noble, M.; Barrett, P.; Endicott, J.; Johnson, L.; McDonnell, J.; Robertson, G.; Zawaira, A. Biochim. Biophys. Acta 2005, 1754, 58-64.
-
(2005)
Biochim. Biophys. Acta
, vol.1754
, pp. 58-64
-
-
Noble, M.1
Barrett, P.2
Endicott, J.3
Johnson, L.4
McDonnell, J.5
Robertson, G.6
Zawaira, A.7
-
32
-
-
0035924235
-
-
Honma, T.; Hayashi, K.; Aoyama, T.; Hashimoto, O.; Machida, T.; Fukasawa, K.; Iwama, T.; Ikeura, G; Ikuta, M.; Suzuki-Takahashi, I. J. Med. Chem. 2000, 44, 4615-4627.
-
(2000)
J. Med. Chem
, vol.44
, pp. 4615-4627
-
-
Honma, T.1
Hayashi, K.2
Aoyama, T.3
Hashimoto, O.4
Machida, T.5
Fukasawa, K.6
Iwama, T.7
Ikeura, G.8
Ikuta, M.9
Suzuki-Takahashi, I.10
-
33
-
-
0035924240
-
-
Honma, T.; Yoshizumi, T.; Hashimoto, N.; Hayashi, K.; Kawanishi, N.; Fukasawa, K.; Takaki, T.; Ikeura, C.; Ikuta, M.; Suzuki-Takahashi, I.; Hayama, T.; Nishimura, S.; Morishima, H. J. Med. Chem. 2001, 44, 4628-4640.
-
(2001)
J. Med. Chem
, vol.44
, pp. 4628-4640
-
-
Honma, T.1
Yoshizumi, T.2
Hashimoto, N.3
Hayashi, K.4
Kawanishi, N.5
Fukasawa, K.6
Takaki, T.7
Ikeura, C.8
Ikuta, M.9
Suzuki-Takahashi, I.10
Hayama, T.11
Nishimura, S.12
Morishima, H.13
-
34
-
-
0031037714
-
-
Meijer, L.; Borgne, A.; Mulner, O.; Chong, J. P.; Blow, J. J.; Inagaki, N. Eur. J. Biochem. 1997, 243, 527-536.
-
(1997)
Eur. J. Biochem
, vol.243
, pp. 527-536
-
-
Meijer, L.1
Borgne, A.2
Mulner, O.3
Chong, J.P.4
Blow, J.J.5
Inagaki, N.6
-
35
-
-
0033128165
-
-
Hoessel, R.; Leclerc, S.; Endicott, J. A.; Nobel, M. E.; Lawrie, A.; Tunnah, P.; Leost, M.; Damiens, E.; Marie, D.; Marko, D.; Niederberger, E.; Tang, W.; Eisenbrand, G.; Meijer, L. Nat. Cell Biol. 1997, 1, 60-67.
-
(1997)
Nat. Cell Biol
, vol.1
, pp. 60-67
-
-
Hoessel, R.1
Leclerc, S.2
Endicott, J.A.3
Nobel, M.E.4
Lawrie, A.5
Tunnah, P.6
Leost, M.7
Damiens, E.8
Marie, D.9
Marko, D.10
Niederberger, E.11
Tang, W.12
Eisenbrand, G.13
Meijer, L.14
-
36
-
-
35248883847
-
-
France
-
Meijer, L.; Guyard, N.; Skaltsounis, L. A.; Eisenbrand, G. Indirubin, the red shade of indigo; Place Georges Teissier: Roscoff, France, 2006.
-
(2006)
Indirubin, the red shade of indigo; Place Georges Teissier: Roscoff
-
-
Meijer, L.1
Guyard, N.2
Skaltsounis, L.A.3
Eisenbrand, G.4
-
37
-
-
20444445904
-
-
Jautelat, R.; Brumby, T.; Schäfer, M.; Briem, H.; Eisenbrand, G.; Schwann, S.; Krüger, M.; Lucking, U.; Prien, O.; Siemeister, G. ChemBioChem 2005, 6, 531-540.
-
(2005)
ChemBioChem
, vol.6
, pp. 531-540
-
-
Jautelat, R.1
Brumby, T.2
Schäfer, M.3
Briem, H.4
Eisenbrand, G.5
Schwann, S.6
Krüger, M.7
Lucking, U.8
Prien, O.9
Siemeister, G.10
-
38
-
-
33750205026
-
-
Zhang, B.; Tan, V. B. C.; Lim, K. M.; Tay, T. E. J. Comput.-Aided. Mol. Res. 2006, 20, 395-404.
-
(2006)
J. Comput.-Aided. Mol. Res
, vol.20
, pp. 395-404
-
-
Zhang, B.1
Tan, V.B.C.2
Lim, K.M.3
Tay, T.E.4
-
39
-
-
34648853657
-
-
Zhang, B.; Tan, V. B. C.; Lim, K. M.; Tay, T. E.; Zhuang, S. L. J. Mol. Model. 2007, 13, 79-89.
-
(2007)
J. Mol. Model
, vol.13
, pp. 79-89
-
-
Zhang, B.1
Tan, V.B.C.2
Lim, K.M.3
Tay, T.E.4
Zhuang, S.L.5
-
40
-
-
0035576134
-
-
Cavalli, A.; Dezi, C.; Folkers, G.; Scapozza, L.; Recanatini, M. Proteins: Struct., Funct., Genet. 2001, 45, 478-485.
-
(2001)
Proteins: Struct., Funct., Genet
, vol.45
, pp. 478-485
-
-
Cavalli, A.1
Dezi, C.2
Folkers, G.3
Scapozza, L.4
Recanatini, M.5
-
41
-
-
1842866544
-
-
Otyepka, M.; Kříž, Z.; Koča, J. J. Biomol. Struct. Dynam. 2002, 20, 141-154.
-
(2002)
J. Biomol. Struct. Dynam
, vol.20
, pp. 141-154
-
-
Otyepka, M.1
Kříž, Z.2
Koča, J.3
-
42
-
-
0036399607
-
-
De Azevedo, W. F., Jr.; Gaspar, R. T.; Canduri, F.; Camera, J. C., Jr.; Silveira, N. J. F. Biochem. Biophys. Res. Commun. 2002, 297, 1154-1158.
-
(2002)
Biochem. Biophys. Res. Commun
, vol.297
, pp. 1154-1158
-
-
De Azevedo Jr., W.F.1
Gaspar, R.T.2
Canduri, F.3
Camera Jr., J.C.4
Silveira, N.J.F.5
-
44
-
-
0037479908
-
-
Sims, P. A.; Wong, C. F.; McCammon, J. A. J. Med. Chem. 2003, 46, 3314-3325.
-
(2003)
J. Med. Chem
, vol.46
, pp. 3314-3325
-
-
Sims, P.A.1
Wong, C.F.2
McCammon, J.A.3
-
45
-
-
10844242972
-
-
Park, H.; Yeom, M. S.; Lee, S. ChemBioChem 2004, 5, 1662-1672.
-
(2004)
ChemBioChem
, vol.5
, pp. 1662-1672
-
-
Park, H.1
Yeom, M.S.2
Lee, S.3
-
46
-
-
2442667660
-
-
Bártová, 1.; Otyepka, M.; Kříž, Z.; Koča, J. Protein Sci. 2004, 13, 1449-1457.
-
Bártová, 1.; Otyepka, M.; Kříž, Z.; Koča, J. Protein Sci. 2004, 13, 1449-1457.
-
-
-
-
47
-
-
13244287683
-
-
Bártová, I.; Otyepka, M.; Kříž, Z.; Koča, J. Protein Sci. 2005, 14, 445-451.
-
(2005)
Protein Sci
, vol.14
, pp. 445-451
-
-
Bártová, I.1
Otyepka, M.2
Kříž, Z.3
Koča, J.4
-
48
-
-
29244436902
-
-
Jiang, Y.-J.; Zou, J.-W.; Gui, C.-S. J. Mol. Model. 2005, 11, 509-517.
-
(2005)
J. Mol. Model
, vol.11
, pp. 509-517
-
-
Jiang, Y.-J.1
Zou, J.-W.2
Gui, C.-S.3
-
50
-
-
33646379621
-
-
Otyepka, M.; Bártovaá, I.; Kříž, Z.; Koča, J. J. Biol. Chem. 2006, 257, 7271-7281.
-
(2006)
J. Biol. Chem
, vol.257
, pp. 7271-7281
-
-
Otyepka, M.1
Bártovaá, I.2
Kříž, Z.3
Koča, J.4
-
51
-
-
0029011701
-
-
Cornell, W. D.; Cieplak, P.; Bayly, C. I.; Gould, I. R.; Merz, K. M.; Ferguson, D. M., Jr.; Spellmeyer, D. C.; Fox, T.; Caldwell, J. W.; Kollman, P. A. J. Am. Chem. Soc. 1995, 117, 5179-5197.
-
(1995)
J. Am. Chem. Soc
, vol.117
, pp. 5179-5197
-
-
Cornell, W.D.1
Cieplak, P.2
Bayly, C.I.3
Gould, I.R.4
Merz, K.M.5
Ferguson Jr., D.M.6
Spellmeyer, D.C.7
Fox, T.8
Caldwell, J.W.9
Kollman, P.A.10
-
52
-
-
84986492477
-
-
Besler, B. H.; Merz, K. M.; Kollman, P. A. J. Comput. Chem. 1990, 11, 431-439.
-
(1990)
J. Comput. Chem
, vol.11
, pp. 431-439
-
-
Besler, B.H.1
Merz, K.M.2
Kollman, P.A.3
-
54
-
-
9244260409
-
-
University of California: San Francisco, CA
-
Case, D. A.; Pearlman, D. A.; Caldwell, J. W.; Cheatham, T. E., III; Wang, J.; Ross, W. S.; Simmerling, G L.; Darden, T. A.; Merz, K. M.; Stanton, R. V.; Cheng, A. L.; Vincent, J. J.; Crowley, M.; Tsui, V.; Gohlke, H.; Radme, R. J.; Duan, Y.; Pitera, J.; Massova, I.; Scibel, G. L.; Singh, U. C.; Weiner, P. K.; Kollman, P. A. AMBER 8; University of California: San Francisco, CA, 2004.
-
(2004)
AMBER 8
-
-
Case, D.A.1
Pearlman, D.A.2
Caldwell, J.W.3
Cheatham III, T.E.4
Wang, J.5
Ross, W.S.6
Simmerling, G.L.7
Darden, T.A.8
Merz, K.M.9
Stanton, R.V.10
Cheng, A.L.11
Vincent, J.J.12
Crowley, M.13
Tsui, V.14
Gohlke, H.15
Radme, R.J.16
Duan, Y.17
Pitera, J.18
Massova, I.19
Scibel, G.L.20
Singh, U.C.21
Weiner, P.K.22
Kollman, P.A.23
more..
-
55
-
-
0004016501
-
-
Jorgensen, W. L.; Chandrasekhar, J.; Madura, J. D.; Impey, R. W.; Klein, M. L. J. Chem. Phys. 1983, 79, 926-935.
-
(1983)
J. Chem. Phys
, vol.79
, pp. 926-935
-
-
Jorgensen, W.L.1
Chandrasekhar, J.2
Madura, J.D.3
Impey, R.W.4
Klein, M.L.5
-
56
-
-
33846823909
-
-
Darden, T.; York, D.; Pedersen, L. J. Chem. Phys. 1993, 98, 10089-10092.
-
(1993)
J. Chem. Phys
, vol.98
, pp. 10089-10092
-
-
Darden, T.1
York, D.2
Pedersen, L.3
-
57
-
-
33646940952
-
-
Ryckaert, J. P.; Ciccotti, G.; Berendsen, H. J. C. J. Comput. Phys. 1977, 23, 327-341.
-
(1977)
J. Comput. Phys
, vol.23
, pp. 327-341
-
-
Ryckaert, J.P.1
Ciccotti, G.2
Berendsen, H.J.C.3
-
58
-
-
35248850216
-
-
Morris, G. M, Goodsell, D. S, Huey, R, Hart, W. E, Halliday, S, Belew, R, Olson, A. J. Autodock Version 3.0.3; Molecular Graphics Laboratory, Department of Molecular Biology, The Scripps Research Institute: 1999
-
Morris, G. M.; Goodsell, D. S.; Huey, R.; Hart, W. E.; Halliday, S.; Belew, R.; Olson, A. J. Autodock Version 3.0.3; Molecular Graphics Laboratory, Department of Molecular Biology, The Scripps Research Institute: 1999.
-
-
-
-
59
-
-
11644261806
-
-
Morris, G. M.; Goodsell, D. S.; Halliday, R. S.; Huey, R.; Hart, W. E.; Belew, R. K.; Olson, A. J. J. Comput. Chem. 1998, 19, 1639-1662.
-
(1998)
J. Comput. Chem
, vol.19
, pp. 1639-1662
-
-
Morris, G.M.1
Goodsell, D.S.2
Halliday, R.S.3
Huey, R.4
Hart, W.E.5
Belew, R.K.6
Olson, A.J.7
-
60
-
-
0029029617
-
-
Jeffrey, P. D.; Russo, A. A.; Polyak, K.; Gibbs, E.; Hurwitz, J.; Massague, J. N.; Pavletich, P. Nature 1995, 376, 313-320.
-
(1995)
Nature
, vol.376
, pp. 313-320
-
-
Jeffrey, P.D.1
Russo, A.A.2
Polyak, K.3
Gibbs, E.4
Hurwitz, J.5
Massague, J.N.6
Pavletich, P.7
-
61
-
-
13444253813
-
-
Mapelli, M.; Massimiliano, L.; Crovace, C.; Seeliger, M. A.; Tsai, L. H.; Meijer, L.; Musacchio, A. J. Med. Chem. 2005, 48, 671-679.
-
(2005)
J. Med. Chem
, vol.48
, pp. 671-679
-
-
Mapelli, M.1
Massimiliano, L.2
Crovace, C.3
Seeliger, M.A.4
Tsai, L.H.5
Meijer, L.6
Musacchio, A.7
-
62
-
-
0034651984
-
-
García, A. E.; Hummer, G. Proteins: Struct., Funct., Genet. 2000, 38, 261-272.
-
(2000)
Proteins: Struct., Funct., Genet
, vol.38
, pp. 261-272
-
-
García, A.E.1
Hummer, G.2
-
63
-
-
0034988970
-
-
Davies, T. G.; Tunnah, P.; Meijer, L.; Marko, D.; Eisenbrand, G.; Endicott, J. A.; Noble, M. E. M. Structure 2001, 9, 389-397.
-
(2001)
Structure
, vol.9
, pp. 389-397
-
-
Davies, T.G.1
Tunnah, P.2
Meijer, L.3
Marko, D.4
Eisenbrand, G.5
Endicott, J.A.6
Noble, M.E.M.7
-
65
-
-
0037062580
-
-
Cook, A.; Lowe, E. D.; Chrysina, E. D.; Skamnaki, V. T.; Oikonomakos, N. G.; Johnson, L. N. Biochemistry 2002, 41, 7301-7311.
-
(2002)
Biochemistry
, vol.41
, pp. 7301-7311
-
-
Cook, A.1
Lowe, E.D.2
Chrysina, E.D.3
Skamnaki, V.T.4
Oikonomakos, N.G.5
Johnson, L.N.6
-
66
-
-
0033224309
-
-
Brown, N. R.; Noble, M. E.; Endicott, J. A.; Johnson, L. N. Afar. Cell Biol. 1999, 1, 438-443.
-
(1999)
Afar. Cell Biol
, vol.1
, pp. 438-443
-
-
Brown, N.R.1
Noble, M.E.2
Endicott, J.A.3
Johnson, L.N.4
-
67
-
-
35248889858
-
-
Part of the inhibitor-water-Aspl45 involved CDK2/inhibitor crystal structures ID are as follows: IE1X, 1GZ8, 1H1R, 1H1S, 1O1R, 2C50, 2A0C, 1HOl, 1H07, 1H08, etc.
-
Part of the inhibitor-water-Aspl45 involved CDK2/inhibitor crystal structures ID are as follows: IE1X, 1GZ8, 1H1R, 1H1S, 1O1R, 2C50, 2A0C, 1HOl, 1H07, 1H08, etc.
-
-
-
|