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1JIM	STEREOSPECIFIC REACTION OF 3-METHOXY-4-CHLORO-7-AMINOISOCOUMARIN WITH CRYSTALLINE PORCINE PANCREATIC ELASTASE Descriptor: METHYL(2-ACETOXY-2-(2-CARBOXY-4-AMINO-PHENYL))ACETATE, PORCINE PANCREATIC ELASTASE, SULFATE ION Authors: Meyer, E. Deposit date: 1993-03-19 Release date: 1994-01-31 Last modified: 2024-06-05 Method: X-RAY DIFFRACTION (2.31 Å) Cite: Stereospecific Reaction of 3-Methoxy-4-Chloro-7-Aminoisocoumarin with Crystalline Porcine Pancreatic Elastase J.Am.Chem.Soc., 107, 1985
1JPO	LOW TEMPERATURE ORTHORHOMBIC LYSOZYME Descriptor: LYSOZYME Authors: Bradbrook, G.M, Helliwell, J.R, Habash, J. Deposit date: 1997-07-03 Release date: 1997-11-12 Last modified: 2024-06-05 Method: X-RAY DIFFRACTION (2.1 Å) Cite: Time-Resolved Biological and Perturbation Chemical Crystallography: Laue and Monochromatic Developments Time-Resolved Electron and X-Ray Diffraction; 13-14 July 1995, San Diego, California (in: Proc.Spie-Int.Soc.Opt.Eng., V.2521), 1995
1JRT	HEMIACETAL COMPLEX BETWEEN LEUPEPTIN AND TRYPSIN Descriptor: CALCIUM ION, LEUPEPTIN, TRYPSIN Authors: Kurinov, I.V, Harrison, R.W. Deposit date: 1996-02-07 Release date: 1996-10-14 Last modified: 2024-06-05 Method: X-RAY DIFFRACTION (1.7 Å) Cite: Two crystal structures of the leupeptin-trypsin complex. Protein Sci., 5, 1996
3NDM	Crystal structure of Rho-Associated Protein Kinase (ROCK1) with a potent isoquinolone derivative Descriptor: (3S,4R)-N-(7-chloro-1-oxo-1,4-dihydroisoquinolin-6-yl)-4-(4-chlorophenyl)pyrrolidine-3-carboxamide, Rho-Associated Protein Kinase (ROCK1) Authors: Li, X. Deposit date: 2010-06-07 Release date: 2010-12-08 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (3.3 Å) Cite: Substituted 2H-isoquinolin-1-ones as potent Rho-kinase inhibitors: part 3, aryl substituted pyrrolidines. Bioorg.Med.Chem.Lett., 20, 2010
1JHL	THREE-DIMENSIONAL STRUCTURE OF A HETEROCLITIC ANTIGEN-ANTIBODY CROSS-REACTION COMPLEX Descriptor: IGG1-KAPPA D11.15 FV (HEAVY CHAIN), IGG1-KAPPA D11.15 FV (LIGHT CHAIN), PHEASANT EGG WHITE LYSOZYME Authors: Chitarra, V, Alzari, P.M, Bentley, G.A, Bhat, T.N, Eisele, J.-L, Poljak, R.J. Deposit date: 1993-05-04 Release date: 1994-01-31 Last modified: 2024-06-05 Method: X-RAY DIFFRACTION (2.4 Å) Cite: Three-dimensional structure of a heteroclitic antigen-antibody cross-reaction complex. Proc.Natl.Acad.Sci.USA, 90, 1993
1JRS	HEMIACETAL COMPLEX BETWEEN LEUPEPTIN AND TRYPSIN Descriptor: CALCIUM ION, Leupeptin, TRYPSIN Authors: Kurinov, I.V, Harrison, R.W. Deposit date: 1996-02-07 Release date: 1996-10-14 Last modified: 2024-06-05 Method: X-RAY DIFFRACTION (1.8 Å) Cite: Two crystal structures of the leupeptin-trypsin complex. Protein Sci., 5, 1996
1K58	Crystal Structure of Human Angiogenin Variant D116H Descriptor: Angiogenin Authors: Leonidas, D.D, Shapiro, R, Subbarao, G.V, Russo, A, Acharya, K.R. Deposit date: 2001-10-10 Release date: 2002-03-20 Last modified: 2023-08-16 Method: X-RAY DIFFRACTION (2.7 Å) Cite: Crystallographic studies on the role of the C-terminal segment of human angiogenin in defining enzymatic potency. Biochemistry, 41, 2002
1K6T	LACK OF SYNERGY FOR INHIBITORS TARGETING A MULTI-DRUG RESISTANT HIV-1 PROTEASE Descriptor: ACETATE ION, N-[2-HYDROXY-1-INDANYL]-5-[(2-TERTIARYBUTYLAMINOCARBONYL)-4(3-PYRIDYLMETHYL)PIPERAZINO]-4-HYDROXY-2-(1-PHENYLETHYL)-PEN TANAMIDE, POL polyprotein Authors: Schiffer, C.A. Deposit date: 2001-10-17 Release date: 2002-02-06 Last modified: 2023-08-16 Method: X-RAY DIFFRACTION (2.25 Å) Cite: Lack of synergy for inhibitors targeting a multi-drug-resistant HIV-1 protease. Protein Sci., 11, 2002
3NHA	Nucleotide Binding Domain of Human ABCB6 (ADP Mg bound structure) Descriptor: ADENOSINE-5'-DIPHOSPHATE, ATP-binding cassette sub-family B member 6, mitochondrial, ... Authors: Haffke, M, Menzel, A, Carius, Y, Jahn, D, Heinz, D.W. Deposit date: 2010-06-14 Release date: 2010-08-25 Last modified: 2023-09-06 Method: X-RAY DIFFRACTION (2.1 Å) Cite: Structures of the nucleotide-binding domain of the human ABCB6 transporter and its complexes with nucleotides. Acta Crystallogr.,Sect.D, 66, 2010
3NHM	Crystal structure of a response regulator from Myxococcus xanthus Descriptor: Response regulator Authors: Palani, K, Burley, S.K, Swaminathan, S, New York SGX Research Center for Structural Genomics (NYSGXRC) Deposit date: 2010-06-14 Release date: 2010-07-21 Last modified: 2023-11-22 Method: X-RAY DIFFRACTION (2.19 Å) Cite: Crystal structure of a response regulator from Myxococcus xanthus To be Published
3NDF	Cleaved antitrypsin with P8-P6 Asp Descriptor: Alpha-1-antitrypsin Authors: Huntington, J.A, Sendall, T.J, Yamasaki, M. Deposit date: 2010-06-07 Release date: 2010-07-28 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (2.7 Å) Cite: Loop-sheet mechanism of serpin polymerization tested by reactive center loop mutations J. Biol. Chem., 285, 2010
3NDU	HIV-1 Protease Saquinavir:Ritonavir 1:5 complex structure Descriptor: (2S)-N-[(2S,3R)-4-[(2S,3S,4aS,8aS)-3-(tert-butylcarbamoyl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-3-hydroxy-1 -phenyl-butan-2-yl]-2-(quinolin-2-ylcarbonylamino)butanediamide, ACETATE ION, CHLORIDE ION, ... Authors: Geremia, S, Olajuyigbe, F.M, Demitri, N. Deposit date: 2010-06-08 Release date: 2011-07-20 Last modified: 2023-09-06 Method: X-RAY DIFFRACTION (1.25 Å) Cite: Investigation of 2-Fold Disorder of Inhibitors and Relative Potency by Crystallizations of HIV-1 Protease in Ritonavir and Saquinavir Mixtures Cryst.Growth Des., 11, 2011
1K6C	LACK OF SYNERGY FOR INHIBITORS TARGETING A MULTI-DRUG RESISTANT HIV-1 PROTEASE Descriptor: ACETATE ION, N-[2(R)-HYDROXY-1(S)-INDANYL]-5-[(2(S)-TERTIARY BUTYLAMINOCARBONYL)-4(3-PYRIDYLMETHYL)PIPERAZINO]-4(S)-HYDROXY-2(R)-PHENYLMETHYLPENTANAMIDE, POL polyprotein Authors: Schiffer, C.A. Deposit date: 2001-10-15 Release date: 2002-02-06 Last modified: 2023-08-16 Method: X-RAY DIFFRACTION (2.2 Å) Cite: Lack of synergy for inhibitors targeting a multi-drug-resistant HIV-1 protease. Protein Sci., 11, 2002
1K76	Solution Structure of the C-terminal Sem-5 SH3 Domain (Minimized Average Structure) Descriptor: SEX MUSCLE ABNORMAL PROTEIN 5 Authors: Ferreon, J, Volk, D, Luxon, B, Gorenstein, D, Hilser, V. Deposit date: 2001-10-18 Release date: 2003-05-20 Last modified: 2024-05-22 Method: SOLUTION NMR Cite: Solution Structure, Dynamics and Thermodynamics of the Native State Ensemble of Sem-5 C-Terminal SH3 Domain Biochemistry, 42, 2003
1K5B	Crystal Structure of Human Angiogenin Variant des(121-123) Descriptor: Angiogenin, CITRIC ACID Authors: Leonidas, D.D, Shapiro, R, Subbarao, G.V, Russo, A, Acharya, K.R. Deposit date: 2001-10-10 Release date: 2002-03-20 Last modified: 2023-08-16 Method: X-RAY DIFFRACTION (1.8 Å) Cite: Crystallographic studies on the role of the C-terminal segment of human angiogenin in defining enzymatic potency. Biochemistry, 41, 2002
1K59	Crystal Structure of Human Angiogenin Variant Q117G Descriptor: CITRIC ACID, angiogenin Authors: Leonidas, D.D, Shapiro, R, Subbarao, G.V, Russo, A, Acharya, K.R. Deposit date: 2001-10-10 Release date: 2002-03-20 Last modified: 2023-08-16 Method: X-RAY DIFFRACTION (1.8 Å) Cite: Crystallographic studies on the role of the C-terminal segment of human angiogenin in defining enzymatic potency. Biochemistry, 41, 2002
3MZS	Crystal Structure of Cytochrome P450 CYP11A1 in complex with 22-hydroxy-cholesterol Descriptor: (3alpha,8alpha,22R)-cholest-5-ene-3,22-diol, Cholesterol side-chain cleavage enzyme, ISOPROPYL ALCOHOL, ... Authors: Stout, C.D, Annalora, A, Mast, N, Pikuleva, I. Deposit date: 2010-05-12 Release date: 2010-12-15 Last modified: 2023-09-06 Method: X-RAY DIFFRACTION (2.5 Å) Cite: Structural Basis for Three-step Sequential Catalysis by the Cholesterol Side Chain Cleavage Enzyme CYP11A1. J.Biol.Chem., 286, 2011
3N8M	Crystal Structure of the Grb2 SH2 Domain in Complex with An Acyclic Ligand Having the Sequence pYVNVP Descriptor: GLYCEROL, Growth factor receptor-bound protein 2, PEPTIDE Authors: Whiddon, B.B, Clements, J.H, Martin, S.F. Deposit date: 2010-05-28 Release date: 2010-12-15 Last modified: 2023-11-22 Method: X-RAY DIFFRACTION (2 Å) Cite: Thermodynamic and Structural Effects of Macrocyclization as a Constraining Method in Protein-Ligand Interactions. ACS MED.CHEM.LETT., 1, 2010
1K68	Crystal Structure of the Phosphorylated Cyanobacterial Phytochrome Response Regulator RcpA Descriptor: MAGNESIUM ION, Phytochrome Response Regulator RcpA Authors: Benda, C, Scheufler, C, Tandeau de Marsac, N, Gaertner, W. Deposit date: 2001-10-15 Release date: 2003-12-16 Last modified: 2011-07-13 Method: X-RAY DIFFRACTION (1.9 Å) Cite: Crystal structures of two cyanobacterial response regulators in apo- and phosphorylated form reveal a novel dimerization motif of phytochrome-associated response regulators Biophys.J., 87, 2004
3NC7	CYP134A1 2-phenylimidazole bound structure Descriptor: 2-phenyl-1H-imidazole, Cytochrome P450 cypX, MAGNESIUM ION, ... Authors: Cryle, M.J, Schlichting, I. Deposit date: 2010-06-04 Release date: 2010-08-11 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (3.3 Å) Cite: Structural and biochemical characterization of the cytochrome P450 CypX (CYP134A1) from Bacillus subtilis: a cyclo-L-leucyl-L-leucyl dipeptide oxidase. Biochemistry, 49, 2010
1K5A	Crystal structure of human angiogenin double variant I119A/F120A Descriptor: Angiogenin Authors: Leonidas, D.D, Shapiro, R, Subbarao, G.V, Russo, A, Acharya, K.R. Deposit date: 2001-10-10 Release date: 2002-03-20 Last modified: 2023-08-16 Method: X-RAY DIFFRACTION (2.33 Å) Cite: Crystallographic studies on the role of the C-terminal segment of human angiogenin in defining enzymatic potency. Biochemistry, 41, 2002
3NDA	Crystal structure of serpin from tick Ixodes ricinus Descriptor: PENTAETHYLENE GLYCOL, Serpin-2 Authors: Rezacova, P, Kovarova, Z, Chmelar, J, Mares, M. Deposit date: 2010-06-07 Release date: 2010-10-27 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (1.8 Å) Cite: A tick salivary protein targets cathepsin G and chymase and inhibits host inflammation and platelet aggregation. Blood, 117, 2011
1K6P	LACK OF SYNERGY FOR INHIBITORS TARGETING A MULTI-DRUG RESISTANT HIV-1 PROTEASE Descriptor: ACETATE ION, N-[2(R)-HYDROXY-1(S)-INDANYL]-5-[(2(S)-TERTIARY BUTYLAMINOCARBONYL)-4(BENZO[1,3]DIOXOL-5-YLMETHYL)-PIPERAZINO]-4(S)-HYDROXY-2(R)-PHENYLMETHYLPENTANAMIDE, POL polyprotein Authors: Schiffer, C.A. Deposit date: 2001-10-16 Release date: 2002-02-06 Last modified: 2024-04-03 Method: X-RAY DIFFRACTION (2.2 Å) Cite: Lack of synergy for inhibitors targeting a multi-drug-resistant HIV-1 protease. Protein Sci., 11, 2002
3NDW	HIV-1 Protease Saquinavir:Ritonavir 1:15 complex structure Descriptor: ACETATE ION, DIMETHYL SULFOXIDE, Protease, ... Authors: Geremia, S, Olajuyigbe, F.M, Demitri, N. Deposit date: 2010-06-08 Release date: 2011-07-20 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (1.14 Å) Cite: Investigation of 2-Fold Disorder of Inhibitors and Relative Potency by Crystallizations of HIV-1 Protease in Ritonavir and Saquinavir Mixtures Cryst.Growth Des., 11, 2011
3NE4	1.8 Angstrom structure of intact native wild-type alpha-1-antitrypsin Descriptor: Alpha-1-antitrypsin Authors: Patschull, A.O.M, Gooptu, B, Segu, L. Deposit date: 2010-06-08 Release date: 2011-12-14 Last modified: 2023-09-06 Method: X-RAY DIFFRACTION (1.81 Å) Cite: Therapeutic target-site variability in [alpha]1-antitrypsin characterized at high resolution Acta Crystallogr.,Sect.F, 67, 2011

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