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2WSE	Improved Model of Plant Photosystem I Descriptor: 1,2-DISTEAROYL-MONOGALACTOSYL-DIGLYCERIDE, AT3G54890, BETA-CAROTENE, ... Authors: Amunts, A, Toporik, H, Borovikov, A, Nelson, N. Deposit date: 2009-09-05 Release date: 2009-11-17 Last modified: 2020-07-29 Method: X-RAY DIFFRACTION (3.49 Å) Cite: Structure determination and improved model of plant photosystem I J. Biol. Chem., 285, 2010
3B1J	Crystal structure of Glyceraldehyde-3-Phosphate Dehydrogenase complexed with CP12 in the presence of copper from Synechococcus elongatus Descriptor: COPPER (II) ION, CP12, Glyceraldehyde 3-phosphate dehydrogenase (NADP+), ... Authors: Matsumura, H, Kai, A, Inoue, T. Deposit date: 2011-07-04 Release date: 2012-01-11 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (2.2 Å) Cite: Structure Basis for the Regulation of Glyceraldehyde-3-Phosphate Dehydrogenase Activity via the Intrinsically Disordered Protein CP12. Structure, 19, 2011
3RXJ	Crystal structure of Trypsin complexed with 4-guanidinobenzoic acid Descriptor: 4-carbamimidamidobenzoic acid, CALCIUM ION, Cationic trypsin, ... Authors: Yamane, J, Yao, M, Zhou, Y, Tanaka, I. Deposit date: 2011-05-10 Release date: 2011-08-24 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (1.7 Å) Cite: In-crystal affinity ranking of fragment hit compounds reveals a relationship with their inhibitory activities J.Appl.Crystallogr., 44, 2011
3RXU	Crystal structure of Trypsin complexed with benzamide (F05 and A06, cocktail experiment) Descriptor: BENZAMIDINE, CALCIUM ION, Cationic trypsin, ... Authors: Yamane, J, Yao, M, Zhou, Y, Tanaka, I. Deposit date: 2011-05-10 Release date: 2011-08-24 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (1.68 Å) Cite: In-crystal affinity ranking of fragment hit compounds reveals a relationship with their inhibitory activities J.Appl.Crystallogr., 44, 2011
3RXO	Crystal structure of Trypsin complexed with (3-pyrrol-1-ylphenyl)methanamine Descriptor: 1-[3-(1H-pyrrol-1-yl)phenyl]methanamine, CALCIUM ION, Cationic trypsin, ... Authors: Yamane, J, Yao, M, Zhou, Y, Tanaka, I. Deposit date: 2011-05-10 Release date: 2011-08-24 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (1.6 Å) Cite: In-crystal affinity ranking of fragment hit compounds reveals a relationship with their inhibitory activities J.Appl.Crystallogr., 44, 2011
3RXI	Crystal structure of Trypsin complexed with 2-(1H-indol-3-yl)ethanamine Descriptor: 2-(1H-INDOL-3-YL)ETHANAMINE, CALCIUM ION, Cationic trypsin, ... Authors: Yamane, J, Yao, M, Zhou, Y, Tanaka, I. Deposit date: 2011-05-10 Release date: 2011-08-24 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (1.6 Å) Cite: In-crystal affinity ranking of fragment hit compounds reveals a relationship with their inhibitory activities J.Appl.Crystallogr., 44, 2011
3S22	AMP-C BETA-LACTAMASE (PSEUDOMONAS AERUGINOSA) in complex with an inhibitor Descriptor: Beta-lactamase, CHLORIDE ION, [(2S,3R)-2-formyl-1-{[4-(methylamino)butyl]carbamoyl}pyrrolidin-3-yl]sulfamic acid Authors: Scapin, G, Lu, J, Fitzgerald, P.M.D, Sharma, N. Deposit date: 2011-05-16 Release date: 2011-06-29 Last modified: 2013-06-26 Method: X-RAY DIFFRACTION (1.65 Å) Cite: Side chain SAR of bicyclic Beta-lactamase inhibitors (BLIs). 2. N-Alkylated and open chain analogs of MK-8712 Bioorg.Med.Chem.Lett., 21, 2011
3RXL	Crystal structure of Trypsin complexed with (2,5-dimethyl-3-furyl)methanamine Descriptor: 1-(2,5-dimethylfuran-3-yl)methanamine, CALCIUM ION, Cationic trypsin, ... Authors: Yamane, J, Yao, M, Zhou, Y, Tanaka, I. Deposit date: 2011-05-10 Release date: 2011-08-24 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (1.7 Å) Cite: In-crystal affinity ranking of fragment hit compounds reveals a relationship with their inhibitory activities J.Appl.Crystallogr., 44, 2011
3RXA	Crystal structure of Trypsin complexed with cycloheptanamine Descriptor: CALCIUM ION, Cationic trypsin, GLYCEROL, ... Authors: Yamane, J, Yao, M, Zhou, Y, Tanaka, I. Deposit date: 2011-05-10 Release date: 2011-08-24 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (1.7 Å) Cite: In-crystal affinity ranking of fragment hit compounds reveals a relationship with their inhibitory activities J.Appl.Crystallogr., 44, 2011
3S1K	The Development of Peptide-based Tools for the Analysis of Angiogenesis Descriptor: Vascular endothelial growth factor A, Z-domain Authors: Murray, J.M, Wiesmann, C. Deposit date: 2011-05-15 Release date: 2011-08-17 Method: X-RAY DIFFRACTION (2.55 Å) Cite: The development of Peptide-based tools for the analysis of angiogenesis. Chem.Biol., 18, 2011
3RXK	Crystal structure of Trypsin complexed with methyl 4-amino-1-methyl-pyrrolidine-2-carboxylate Descriptor: CALCIUM ION, Cationic trypsin, DIMETHYL SULFOXIDE, ... Authors: Yamane, J, Yao, M, Zhou, Y, Tanaka, I. Deposit date: 2011-05-10 Release date: 2011-08-24 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (1.6 Å) Cite: In-crystal affinity ranking of fragment hit compounds reveals a relationship with their inhibitory activities J.Appl.Crystallogr., 44, 2011
3RXV	Crystal structure of Trypsin complexed with benzamide (F05 and F03, cocktail experiment) Descriptor: BENZAMIDINE, CALCIUM ION, Cationic trypsin, ... Authors: Yamane, J, Yao, M, Zhou, Y, Tanaka, I. Deposit date: 2011-05-10 Release date: 2011-08-24 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (1.7 Å) Cite: In-crystal affinity ranking of fragment hit compounds reveals a relationship with their inhibitory activities J.Appl.Crystallogr., 44, 2011
2ZJ7	Crystal structure of D157A mutant of Pseudomonas sp. MIS38 lipase Descriptor: CALCIUM ION, Lipase, ZINC ION Authors: Angkawidjaja, C, Kuwahara, K, Kanaya, S. Deposit date: 2008-02-29 Release date: 2008-12-02 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (2.21 Å) Cite: Importance of the Ca2+-binding sites in the N-catalytic domain of a family I.3 lipase for activity and stability Protein Eng.Des.Sel., 21, 2008
3AH6	Remarkable improvement of the heat stability of CutA1 from E.coli by rational protein designing Descriptor: Divalent-cation tolerance protein cutA Authors: Matsuura, Y, Tanaka, T, Bagautdinov, B, Kunishima, N, Yutani, K. Deposit date: 2010-04-15 Release date: 2010-08-11 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (2.4 Å) Cite: Remarkable improvement in the heat stability of CutA1 from Escherichia coli by rational protein design J.Biochem., 148, 2010
3AM6	Crystal structure of the proton pumping rhodopsin AR2 from marine alga Acetabularia acetabulum Descriptor: CHOLESTEROL, RETINAL, rhodopsin-2 Authors: Wada, T, Yokoyama, S. Deposit date: 2010-08-16 Release date: 2011-07-06 Last modified: 2011-12-07 Method: X-RAY DIFFRACTION (3.2 Å) Cite: Crystal structure of the eukaryotic light-driven proton-pumping rhodopsin, Acetabularia rhodopsin II, from marine alga J.Mol.Biol., 411, 2011
3AID	A NEW CLASS OF HIV-1 PROTEASE INHIBITOR: THE CRYSTALLOGRAPHIC STRUCTURE, INHIBITION AND CHEMICAL SYNTHESIS OF AN AMINIMIDE PEPTIDE ISOSTERE Descriptor: BENZOYLAMINO-BENZYL-METHYL-[2-HYDROXY-3-[1-METHYL-ETHYL-OXY-N-FORMAMIDYL]-4-PHENYL-BUTYL]-AMMONIUM, HUMAN IMMUNODEFICIENCY VIRUS PROTEASE Authors: Rutenber, E.E, Stroud, R.M. Deposit date: 1997-05-15 Release date: 1997-09-17 Last modified: 2024-05-22 Method: X-RAY DIFFRACTION (2.5 Å) Cite: A new class of HIV-1 protease inhibitor: the crystallographic structure, inhibition and chemical synthesis of an aminimide peptide isostere. Bioorg.Med.Chem., 4, 1996
3APD	Crystal structure of human PI3K-gamma in complex with CH5108134 Descriptor: 5-(2-Morpholin-4-yl-7-pyridin-3-yl-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-4-yl)-pyrimidin-2-ylamine, Phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit gamma isoform, SULFATE ION Authors: Nakamura, M, Fukami, T.A, Miyazaki, T, Yoshida, M. Deposit date: 2010-10-14 Release date: 2011-04-13 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (2.55 Å) Cite: Discovery and biological activity of a novel class I PI3K inhibitor, CH5132799 Bioorg.Med.Chem.Lett., 21, 2011
3ATK	Crystal structure of trypsin complexed with cycloheptanamine Descriptor: CALCIUM ION, Cationic trypsin, DIMETHYL SULFOXIDE, ... Authors: Yamane, J, Yao, M, Tanaka, I. Deposit date: 2011-01-05 Release date: 2011-08-24 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (1.74 Å) Cite: In-crystal affinity ranking of fragment hit compounds reveals a relationship with their inhibitory activities J.Appl.Crystallogr., 44, 2011
3APC	Crystal structure of human PI3K-gamma in complex with CH5132799 Descriptor: 5-(7-Methanesulfonyl-2-morpholin-4-yl-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-4-yl)-pyrimidin-2-ylamine, Phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit gamma isoform, SULFATE ION Authors: Nakamura, M, Fukami, T.A, Miyazaki, T, Yoshida, M. Deposit date: 2010-10-14 Release date: 2011-04-13 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (2.544 Å) Cite: Discovery and biological activity of a novel class I PI3K inhibitor, CH5132799 Bioorg.Med.Chem.Lett., 21, 2011
3RXB	Crystal structure of Trypsin complexed with 4-guanidinobutanoic acid Descriptor: 4-carbamimidamidobutanoic acid, CALCIUM ION, Cationic trypsin, ... Authors: Yamane, J, Yao, M, Zhou, Y, Tanaka, I. Deposit date: 2011-05-10 Release date: 2011-08-24 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (1.7 Å) Cite: In-crystal affinity ranking of fragment hit compounds reveals a relationship with their inhibitory activities J.Appl.Crystallogr., 44, 2011
3RXP	Crystal structure of Trypsin complexed with (1,5-dimethylpyrazol-3-yl)methanamine Descriptor: 1-(1,5-dimethyl-1H-pyrazol-3-yl)methanamine, CALCIUM ION, Cationic trypsin, ... Authors: Yamane, J, Yao, M, Zhou, Y, Tanaka, I. Deposit date: 2011-05-10 Release date: 2011-08-24 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (1.6 Å) Cite: In-crystal affinity ranking of fragment hit compounds reveals a relationship with their inhibitory activities J.Appl.Crystallogr., 44, 2011
3RXD	Crystal structure of Trypsin complexed with (3-methoxyphenyl)methanamine Descriptor: 1-(3-methoxyphenyl)methanamine, CALCIUM ION, Cationic trypsin, ... Authors: Yamane, J, Yao, M, Zhou, Y, Tanaka, I. Deposit date: 2011-05-10 Release date: 2011-08-24 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (1.7 Å) Cite: In-crystal affinity ranking of fragment hit compounds reveals a relationship with their inhibitory activities J.Appl.Crystallogr., 44, 2011
3ATI	Crystal structure of trypsin complexed with (3-methoxyphenyl)methanamine Descriptor: 1-(3-methoxyphenyl)methanamine, CALCIUM ION, Cationic trypsin, ... Authors: Yamane, J, Yao, M, Tanaka, I. Deposit date: 2011-01-05 Release date: 2011-08-24 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (1.71 Å) Cite: In-crystal affinity ranking of fragment hit compounds reveals a relationship with their inhibitory activities J.Appl.Crystallogr., 44, 2011
3RXM	Crystal structure of Trypsin complexed with [2-(2-thienyl)thiazol-4-yl]methanamine Descriptor: 1-[2-(thiophen-2-yl)-1,3-thiazol-4-yl]methanamine, CALCIUM ION, Cationic trypsin, ... Authors: Yamane, J, Yao, M, Zhou, Y, Tanaka, I. Deposit date: 2011-05-10 Release date: 2011-08-24 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (1.7 Å) Cite: In-crystal affinity ranking of fragment hit compounds reveals a relationship with their inhibitory activities J.Appl.Crystallogr., 44, 2011
3RXH	Crystal structure of Trypsin complexed with 2-(1H-imidazol-4-yl)ethanamine Descriptor: CALCIUM ION, Cationic trypsin, DIMETHYL SULFOXIDE, ... Authors: Yamane, J, Yao, M, Zhou, Y, Tanaka, I. Deposit date: 2011-05-10 Release date: 2011-08-24 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (1.7 Å) Cite: In-crystal affinity ranking of fragment hit compounds reveals a relationship with their inhibitory activities J.Appl.Crystallogr., 44, 2011

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