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4OVO	REFINED X-RAY CRYSTAL STRUCTURES OF THE REACTIVE SITE MODIFIED OVOMUCOID INHIBITOR THIRD DOMAINS FROM SILVER PHEASANT (OMSVP3(ASTERISK)) AND FROM JAPANESE QUAIL (OMJPQ3(ASTERISK)) Descriptor: OVOMUCOID THIRD DOMAIN CLEAVED RDI Authors: Musil, D, Bode, W. Deposit date: 1991-05-13 Release date: 1993-01-15 Last modified: 2024-06-05 Method: X-RAY DIFFRACTION (2.5 Å) Cite: Refined X-ray crystal structures of the reactive site modified ovomucoid inhibitor third domains from silver pheasant (OMSVP3*) and from Japanese quail (OMJPQ3*). J.Mol.Biol., 220, 1991
4CMT	Structure of the Human Anaplastic Lymphoma Kinase in Complex with the inhibitor 3-((1R)-1-(5-fluoro-2-(2H-1,2,3-triazol-2-yl)phenyl)ethoxy)- 5-(3-(methylsulfonyl)phenyl)pyridin-2-amine Descriptor: 3-{(1R)-1-[2-(1,3-dihydro-2H-1,2,3-triazol-2-yl)-5-fluorophenyl]ethoxy}-5-[3-(methylsulfonyl)phenyl]pyridin-2-amine, ALK TYROSINE KINASE RECEPTOR Authors: McTigue, M.A, Deng, Y.L, Liu, W, Brooun, A, Stewart, A.E. Deposit date: 2014-01-17 Release date: 2014-05-28 Last modified: 2023-12-20 Method: X-RAY DIFFRACTION (1.73 Å) Cite: Discovery of (10R)-7-Amino-12-Fluoro-2,10,16-Trimethyl-15-Oxo-10,15,16,17-Tetrahydro-2H-8,4-(Metheno)Pyrazolo[4,3-H][2,5,11]Benzoxadiazacyclotetradecine-3-Carbonitrile (Pf-06463922), a Macrocyclic Inhibitor of Alk/Ros1 with Pre-Clinical Brain Exposure and Broad Spectrum Potency Against Alk-Resistant Mutations. J.Med.Chem., 57, 2014
2JAZ	CRYSTAL STRUCTURE OF THE MUTANT N560D OF THE NUCLEASE DOMAIN OF COLE7 IN COMPLEX WITH IM7 Descriptor: COLICIN E7, COLICIN E7 IMMUNITY PROTEIN, PHOSPHATE ION, ... Authors: Huang, H, Yuan, H.S. Deposit date: 2006-12-01 Release date: 2007-04-03 Last modified: 2023-12-13 Method: X-RAY DIFFRACTION (2.03 Å) Cite: The Conserved Asparagine in the Hnh Motif Serves an Important Structural Role in Metal Finger Endonucleases. J.Mol.Biol., 368, 2007
4BQX	HIF prolyl hydroxylase 2 (PHD2/ EGLN1) in complex with Mn(II) and N-[(1-chloro-4-hydroxyisoquinolin-3-yl)carbonyl]glycine (IOX3/UN9) Descriptor: EGL NINE HOMOLOG 1, MANGANESE (II) ION, N-[(1-CHLORO-4-HYDROXYISOQUINOLIN-3-YL)CARBONYL]GLYCINE Authors: Chowdhury, R, Schofield, C.J. Deposit date: 2013-06-03 Release date: 2013-06-19 Last modified: 2023-12-20 Method: X-RAY DIFFRACTION (1.79 Å) Cite: Selective small molecule probes for the hypoxia inducible factor (HIF) prolyl hydroxylases. ACS Chem. Biol., 8, 2013
4CAA	CLEAVED ANTICHYMOTRYPSIN T345R Descriptor: ANTICHYMOTRYPSIN Authors: Lukacs, C.M, Christianson, D.W. Deposit date: 1997-08-14 Release date: 1998-02-25 Last modified: 2024-05-22 Method: X-RAY DIFFRACTION (2.9 Å) Cite: Engineering an anion-binding cavity in antichymotrypsin modulates the "spring-loaded" serpin-protease interaction. Biochemistry, 37, 1998
2PBZ	Crystal structure of an IMP biosynthesis protein PurP from Thermococcus kodakaraensis Descriptor: ADENOSINE-5'-TRIPHOSPHATE, Hypothetical protein Authors: Agarwal, R, Burley, S.K, Swaminathan, S, New York SGX Research Center for Structural Genomics (NYSGXRC) Deposit date: 2007-03-29 Release date: 2007-04-10 Last modified: 2021-02-03 Method: X-RAY DIFFRACTION (2.5 Å) Cite: Crystal structure of an IMP biosynthesis protein PurP from Thermococcus kodakaraensis To be Published
2JBU	Crystal structure of human insulin degrading enzyme complexed with co- purified peptides. Descriptor: 1,4-DIETHYLENE DIOXIDE, CO-PURIFIED PEPTIDE, INSULIN-DEGRADING ENZYME Authors: Im, H, Shen, Y, Tang, W.J. Deposit date: 2006-12-11 Release date: 2007-07-03 Last modified: 2023-12-13 Method: X-RAY DIFFRACTION (3 Å) Cite: Structure of Substrate-Free Human Insulin Degrading Enzyme (Ide) and Biophysical Analysis of ATP-Induced Conformational Switch of Ide J.Biol.Chem., 282, 2007
2JIA	TYPE III ANTIFREEZE PROTEIN ISOFORM HPLC 12 K61I Descriptor: PROTEIN (ANTIFREEZE PROTEIN TYPE III) Authors: Graether, S.P, Deluca, C.I, Baardsnes, J, Hill, G.A, Davies, P.L, Jia, Z. Deposit date: 1999-01-24 Release date: 1999-04-29 Last modified: 2023-08-30 Method: X-RAY DIFFRACTION (1.6 Å) Cite: Quantitative and qualitative analysis of type III antifreeze protein structure and function. J.Biol.Chem., 274, 1999
2JIE	BETA-GLUCOSIDASE B FROM BACILLUS POLYMYXA COMPLEXED WITH 2-F-GLUCOSE Descriptor: 2-deoxy-2-fluoro-alpha-D-glucopyranose, BETA-GLUCOSIDASE B Authors: Isorna, P, Polaina, J, Sanz-Aparicio, J. Deposit date: 2007-02-28 Release date: 2007-07-03 Last modified: 2023-12-13 Method: X-RAY DIFFRACTION (2.3 Å) Cite: Crystal Structures of Paenibacillus Polymyxa Beta-Glucosidase B Complexes Reveal the Molecular Basis of Substrate Specificity and Give New Insights Into the Catalytic Machinery of Family I Glycosidases. J.Mol.Biol., 371, 2007
2JCW	REDUCED BRIDGE-BROKEN YEAST CU/ZN SUPEROXIDE DISMUTASE ROOM TEMPERATURE (298K) STRUCTURE Descriptor: COPPER (I) ION, CU/ZN SUPEROXIDE DISMUTASE, ZINC ION Authors: Hart, P.J, Balbirnie, M.M, Ogihara, N.L, Nersissian, A.M, Weiss, M.S, Valentine, J.S, Eisenberg, D. Deposit date: 1998-12-21 Release date: 1999-06-08 Last modified: 2023-08-09 Method: X-RAY DIFFRACTION (1.7 Å) Cite: A structure-based mechanism for copper-zinc superoxide dismutase. Biochemistry, 38, 1999
4NOS	HUMAN INDUCIBLE NITRIC OXIDE SYNTHASE WITH INHIBITOR Descriptor: 2-AMINO-6-(1,2-DIHYDROXY-PROPYL)-7,8-DIHYDRO-6H-PTERIDIN-4-ONE, 5,6,7,8-TETRAHYDROBIOPTERIN, ETHYLISOTHIOUREA, ... Authors: Fischmann, T.O, Weber, P.C. Deposit date: 1999-02-03 Release date: 2000-02-04 Last modified: 2023-12-27 Method: X-RAY DIFFRACTION (2.25 Å) Cite: Structural characterization of nitric oxide synthase isoforms reveals striking active-site conservation. Nat.Struct.Biol., 6, 1999
4BQW	HIF prolyl hydroxylase 2 (PHD2/ EGLN1) in complex with Mn(II) and 2-(4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxamido)acetic acid Descriptor: 2-[(1-methyl-2-oxidanyl-4-oxidanylidene-quinolin-3-yl)carbonylamino]ethanoic acid, EGL NINE HOMOLOG 1, MANGANESE (II) ION Authors: Chowdhury, R, Schofield, C.J. Deposit date: 2013-06-03 Release date: 2013-06-19 Last modified: 2023-12-20 Method: X-RAY DIFFRACTION (1.79 Å) Cite: Selective small molecule probes for the hypoxia inducible factor (HIF) prolyl hydroxylases. ACS Chem. Biol., 8, 2013
2LHB	REFINEMENT OF A MOLECULAR MODEL FOR LAMPREY HEMOGLOBIN FROM PETROMYZON MARINUS Descriptor: CYANIDE ION, HEMOGLOBIN V (CYANO MET), PROTOPORPHYRIN IX CONTAINING FE Authors: Honzatko, R.B, Hendrickson, W.A, Love, W.E. Deposit date: 1985-08-16 Release date: 1986-01-21 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (2 Å) Cite: Refinement of a molecular model for lamprey hemoglobin from Petromyzon marinus. J.Mol.Biol., 184, 1985
4E4K	Crystal Structure of PPARgamma with the ligand JO21 Descriptor: (2S)-3-phenyl-2-{[2'-(propan-2-yl)biphenyl-4-yl]oxy}propanoic acid, Peroxisome proliferator-activated receptor gamma Authors: Pochetti, G, Montanari, R, Loiodice, F, Fracchiolla, G, Laghezza, A, Carbonara, G, Piemontese, L, Lavecchia, A, Novellino, E. Deposit date: 2012-03-13 Release date: 2013-01-23 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (2.5 Å) Cite: New 2-(Aryloxy)-3-phenylpropanoic Acids as Peroxisome Proliferator-Activated Receptor alpha/gamma Dual Agonists Able To Upregulate Mitochondrial Carnitine Shuttle System Gene Expression. J.Med.Chem., 56, 2013
4E6H	CRYSTAL STRUCTURE OF THE HAT domain of k. lactis RNA14 Descriptor: mRNA 3'-end-processing protein RNA14 Authors: Paulson, A.R, Tong, L. Deposit date: 2012-03-15 Release date: 2012-05-02 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (2.3 Å) Cite: Crystal structure of the Rna14-Rna15 complex. Rna, 18, 2012
4E7E	E. cloacae C115D MurA in complex with UDP-glucose Descriptor: 1,2-ETHANEDIOL, ACETATE ION, UDP-N-acetylglucosamine 1-carboxyvinyltransferase, ... Authors: Zhu, J.-Y, Yang, Y, Schonbrunn, E. Deposit date: 2012-03-16 Release date: 2013-03-20 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (2.3 Å) Cite: Open-close transition of MurA To be Published
2LAO	THREE-DIMENSIONAL STRUCTURES OF THE PERIPLASMIC LYSINE-, ARGININE-, ORNITHINE-BINDING PROTEIN WITH AND WITHOUT A LIGAND Descriptor: LYSINE, ARGININE, ORNITHINE-BINDING PROTEIN Authors: Kim, S.-H, Oh, B.-H, Kang, C.-H. Deposit date: 1993-02-25 Release date: 1994-06-22 Last modified: 2017-11-29 Method: X-RAY DIFFRACTION (1.9 Å) Cite: Three-dimensional structures of the periplasmic lysine/arginine/ornithine-binding protein with and without a ligand. J.Biol.Chem., 268, 1993
2QKU	The 5th PDZ Domain of InaD in 10mM DTT Descriptor: GLYCEROL, Inactivation-no-after-potential D protein Authors: Ranganathan, R, Socolich, M, Wall, M. Deposit date: 2007-07-11 Release date: 2007-11-06 Last modified: 2011-07-13 Method: X-RAY DIFFRACTION (2.2 Å) Cite: Dynamic Scaffolding in a G Protein-Coupled Signaling System. Cell(Cambridge,Mass.), 131, 2007
4NED	Crystal STRUCTURE OF C-LOBE OF BOVINE LACTOFERRIN COMPLEXED WITH FENOPROFEN AT 2.1 ANGSTROM RESOLUTION Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, CARBONATE ION, ... Authors: Gautam, L, Dube, D, Sinha, M, Kaur, P, Sharma, S, Singh, T.P. Deposit date: 2013-10-29 Release date: 2013-12-11 Last modified: 2023-11-08 Method: X-RAY DIFFRACTION (2.1 Å) Cite: Crystal STRUCTURE OF C-LOBE OF BOVINE LACTOFERRIN COMPLEXED WITH FENOPROFEN AT 2.1 ANGSTROM RESOLUTION To be Published
2GMX	Selective Aminopyridine-Based C-Jun N-terminal Kinase inhibitors with cellular activity Descriptor: C-jun-amino-terminal kinase-interacting protein 1, Mitogen-activated protein kinase 8, N-(4-AMINO-5-CYANO-6-ETHOXYPYRIDIN-2-YL)-2-(4-BROMO-2,5-DIMETHOXYPHENYL)ACETAMIDE, ... Authors: Abad-Zapatero, C. Deposit date: 2006-04-07 Release date: 2006-06-06 Last modified: 2023-08-30 Method: X-RAY DIFFRACTION (3.5 Å) Cite: Aminopyridine-Based c-Jun N-Terminal Kinase Inhibitors with Cellular Activity and Minimal Cross-Kinase Activity. J.Med.Chem., 49, 2006
4PAH	HUMAN PHENYLALANINE HYDROXYLASE CATALYTIC DOMAIN DIMER WITH BOUND NOR-ADRENALINE INHIBITOR Descriptor: FE (III) ION, L-NOREPINEPHRINE, PHENYLALANINE HYDROXYLASE Authors: Erlandsen, H, Flatmark, T, Stevens, R.C. Deposit date: 1998-08-20 Release date: 1999-04-27 Last modified: 2013-02-20 Method: X-RAY DIFFRACTION (2 Å) Cite: Crystallographic analysis of the human phenylalanine hydroxylase catalytic domain with bound catechol inhibitors at 2.0 A resolution. Biochemistry, 37, 1998
2H2H	The Structural basis of sirtuin substrate specificity Descriptor: Histone H4, NAD-dependent deacetylase, ZINC ION Authors: Cosgrove, M.S, Wolberger, C. Deposit date: 2006-05-18 Release date: 2006-12-05 Last modified: 2023-11-15 Method: X-RAY DIFFRACTION (2.2 Å) Cite: The structural basis of sirtuin substrate affinity Biochemistry, 45, 2006
4FIT	FHIT-APO Descriptor: FRAGILE HISTIDINE TRIAD PROTEIN Authors: Lima, C.D, Klein, M.G, Hendrickson, W.A. Deposit date: 1997-09-25 Release date: 1998-03-25 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (2.5 Å) Cite: Structure-based analysis of catalysis and substrate definition in the HIT protein family. Science, 278, 1997
2HDV	Crystal structure of the Src Homology-2 domain of the adapter protein SH2-B Descriptor: SH2-B PH domain containing signaling mediator 1 gamma isoform Authors: Hu, J, Hubbard, S.R. Deposit date: 2006-06-20 Release date: 2006-08-08 Last modified: 2023-08-30 Method: X-RAY DIFFRACTION (2 Å) Cite: Structural Basis for Phosphotyrosine Recognition by the Src Homology-2 Domains of the Adapter Proteins SH2-B and APS. J.Mol.Biol., 361, 2006
2H08	crystal structure of human phosphoribosyl pyrophosphate synthetase 1 mutant Y146M Descriptor: Ribose-phosphate pyrophosphokinase I, SULFATE ION Authors: Li, S, Peng, B, Ding, J. Deposit date: 2006-05-14 Release date: 2006-10-24 Last modified: 2023-10-25 Method: X-RAY DIFFRACTION (2.5 Å) Cite: Crystal structure of human phosphoribosylpyrophosphate synthetase 1 reveals a novel allosteric site Biochem.J., 401, 2007

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