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4OQ5	Crystal Structure of Human MCL-1 Bound to Inhibitor 4-(4-methylnaphthalen-1-yl)-2-{[(4-phenoxyphenyl)sulfonyl]amino}benzoic acid Descriptor: 4-(4-methylnaphthalen-1-yl)-2-{[(4-phenoxyphenyl)sulfonyl]amino}benzoic acid, Induced myeloid leukemia cell differentiation protein Mcl-1 Authors: Petros, A.M, Swann, S.L, Song, D, Swinger, K, Park, C, Zhang, H, Wendt, M.D, Kunzer, A.R, Souers, A.J, Sun, C. Deposit date: 2014-02-07 Release date: 2014-03-12 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (2.86 Å) Cite: Fragment-based discovery of potent inhibitors of the anti-apoptotic MCL-1 protein. Bioorg.Med.Chem.Lett., 24, 2014
4XN7	Crystal Structure of E. coli Aminopeptidase N in complex with L-2,3-Diaminopropionic acid Descriptor: Aminopeptidase N, DIAMINOPROPANOIC ACID, GLYCEROL, ... Authors: Addlagatta, A, Gumpena, R. Deposit date: 2015-01-15 Release date: 2016-03-02 Last modified: 2023-11-08 Method: X-RAY DIFFRACTION (2.22 Å) Cite: Crystal Structure of E. coli Aminopeptidase N in complex with L-2,3-Diaminopropionic acid To Be Published
4XP1	X-ray structure of Drosophila dopamine transporter bound to neurotransmitter dopamine Descriptor: 1,2-ETHANEDIOL, 1-ETHOXY-2-(2-ETHOXYETHOXY)ETHANE, 2-acetamido-2-deoxy-beta-D-glucopyranose, ... Authors: Gouaux, E, Penmatsa, A, Wang, K. Deposit date: 2015-01-16 Release date: 2015-05-06 Last modified: 2020-07-29 Method: X-RAY DIFFRACTION (2.89 Å) Cite: Neurotransmitter and psychostimulant recognition by the dopamine transporter. Nature, 521, 2015
4ORZ	HIV-1 Nef protein in complex with single domain antibody sdAb19 and an engineered Hck SH3 domain Descriptor: Protein Nef, Tyrosine-protein kinase HCK, single domain antibody sdAb19 Authors: Geyer, M, Lulf, S. Deposit date: 2014-02-12 Release date: 2014-03-26 Last modified: 2023-09-20 Method: X-RAY DIFFRACTION (2 Å) Cite: Structural basis for the inhibition of HIV-1 Nef by a high-affinity binding single-domain antibody. Retrovirology, 11, 2014
4XN4	Crystal Structure of Met260Ala mutant of E. coli Aminopeptidase N in complex with L-Methionine Descriptor: Aminopeptidase N, GLYCEROL, MALONATE ION, ... Authors: Addlagatta, A, Gumpena, R. Deposit date: 2015-01-15 Release date: 2016-03-02 Last modified: 2023-11-08 Method: X-RAY DIFFRACTION (1.99 Å) Cite: Crystal Structure of Met260Ala mutant of E. coli Aminopeptidase N in complex with L-Methionine To Be Published
4XNW	The human P2Y1 receptor in complex with MRS2500 Descriptor: P2Y purinoceptor 1,Rubredoxin,P2Y purinoceptor 1, ZINC ION, [(1R,2S,4S,5S)-4-[2-iodo-6-(methylamino)-9H-purin-9-yl]-2-(phosphonooxy)bicyclo[3.1.0]hex-1-yl]methyl dihydrogen phosphate Authors: Zhang, D, Gao, Z, Jacobson, K, Han, G.W, Stevens, R, Zhao, Q, Wu, B, GPCR Network (GPCR) Deposit date: 2015-01-16 Release date: 2015-04-01 Last modified: 2020-02-05 Method: X-RAY DIFFRACTION (2.7 Å) Cite: Two disparate ligand-binding sites in the human P2Y1 receptor Nature, 520, 2015
4XXI	Crystal structure of the Bilin-binding domain of phycobilisome core-membrane linker ApcE Descriptor: PHYCOCYANOBILIN, Phycobiliprotein ApcE Authors: Tang, K, Ding, W.-L, Hoppner, A, Gartner, W, Zhao, K.-H. Deposit date: 2015-01-30 Release date: 2015-12-16 Last modified: 2023-11-08 Method: X-RAY DIFFRACTION (2.2 Å) Cite: The terminal phycobilisome emitter, LCM: A light-harvesting pigment with a phytochrome chromophore Proc.Natl.Acad.Sci.USA, 112, 2015
4XPG	X-ray structure of Drosophila dopamine transporter with subsiteB mutations (D121G/S426M) bound to beta-CFT or Win35428 Descriptor: CHLORIDE ION, CHOLESTEROL, Dopamine transporter, ... Authors: Penmatsa, A, Wang, K.H, Gouaux, E. Deposit date: 2015-01-16 Release date: 2015-05-06 Last modified: 2023-09-27 Method: X-RAY DIFFRACTION (3.21 Å) Cite: Neurotransmitter and psychostimulant recognition by the dopamine transporter. Nature, 521, 2015
4XQC	Crystal Structure of the Homospermidine Synthase (HSS) from Blastochloris viridis in Complex with NAD and 1,3-diaminopropane. Descriptor: 1,3-DIAMINOPROPANE, 3-PYRIDINIUM-1-YLPROPANE-1-SULFONATE, ACETATE ION, ... Authors: Krossa, S. Deposit date: 2015-01-19 Release date: 2016-01-27 Last modified: 2024-01-10 Method: X-RAY DIFFRACTION (1.27 Å) Cite: Comprehensive Structural Characterization of the Bacterial Homospermidine Synthase-an Essential Enzyme of the Polyamine Metabolism. Sci Rep, 6, 2016
4OZ5	Bacillus subtilis HmoB Descriptor: Bacillus subtilis HmoB, PROTOPORPHYRIN IX CONTAINING FE Authors: Choe, J, Park, S. Deposit date: 2014-02-13 Release date: 2015-02-18 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (2.71 Å) Cite: Bacillus subtilis HmoB To Be Published
4XE5	Crystal structure of the Na,K-ATPase from bovine Descriptor: CHOLESTEROL, MAGNESIUM ION, OUABAIN, ... Authors: Gregersen, J.L, Mattle, D, Fedosova, N.U, Nissen, P, Reinhard, L. Deposit date: 2014-12-22 Release date: 2016-03-09 Last modified: 2024-01-10 Method: X-RAY DIFFRACTION (3.901 Å) Cite: Isolation, crystallization and crystal structure determination of bovine kidney Na(+),K(+)-ATPase. Acta Crystallogr.,Sect.F, 72, 2016
4PKH	Complex of ADP-actin With the N-terminal Actin-Binding Domain of Tropomodulin Descriptor: ADENOSINE-5'-DIPHOSPHATE, Actin, alpha skeletal muscle, ... Authors: Rao, J.N, Dominguez, R. Deposit date: 2014-05-14 Release date: 2014-07-30 Last modified: 2023-09-27 Method: X-RAY DIFFRACTION (2.15 Å) Cite: Actin cytoskeleton. Mechanism of actin filament pointed-end capping by tropomodulin. Science, 345, 2014
4XJM	Crystal structure of 7,8-diaminopelargonic acid synthase (BioA) from Mycobacterium tuberculosis, complexed with a HTS lead compound Descriptor: 3-{1-[(5-acetylthiophen-2-yl)carbonyl]piperidin-4-yl}-N-(3-methoxyphenyl)propanamide, Adenosylmethionine-8-amino-7-oxononanoate aminotransferase, PYRIDOXAL-5'-PHOSPHATE Authors: Finzel, B.C, Dai, R. Deposit date: 2015-01-08 Release date: 2016-01-20 Last modified: 2023-09-27 Method: X-RAY DIFFRACTION (1.6 Å) Cite: Fragment based inhibitor design of Mycobacterium tuberculosis BioA (http://hdl.handle.net/11299/171084) Thesis, University of Minnesota, 2015
4XJP	Crystal structure of 7,8-diaminopelargonic acid synthase (BioA) from Mycobacterium tuberculosis, complexed with an inhibitor optimized from HTS lead Descriptor: 1,2-ETHANEDIOL, 1-{4-[4-(1,3-benzodioxol-5-ylcarbonyl)piperazin-1-yl]phenyl}ethanone, Adenosylmethionine-8-amino-7-oxononanoate aminotransferase, ... Authors: Finzel, B.C, Dai, R. Deposit date: 2015-01-08 Release date: 2016-01-20 Last modified: 2023-09-27 Method: X-RAY DIFFRACTION (1.6 Å) Cite: Structure-Based Optimization of Pyridoxal 5'-Phosphate-Dependent Transaminase Enzyme (BioA) Inhibitors that Target Biotin Biosynthesis in Mycobacterium tuberculosis. J. Med. Chem., 60, 2017
4XK1	Crystal Structure of a Phosphoserine/phosphohydroxythreonine Aminotransferase (PSAT) from Pseudomonas aeruginosa with cofactor Pyridoxal Phosphate and bound Glutamate Descriptor: FORMIC ACID, GLUTAMIC ACID, Phosphoserine aminotransferase Authors: Seattle Structural Genomics Center for Infectious Disease (SSGCID) Deposit date: 2015-01-09 Release date: 2015-02-04 Last modified: 2017-10-11 Method: X-RAY DIFFRACTION (2.15 Å) Cite: Crystal Structure of a Phosphoserine/phosphohydroxythreonine Aminotransferase (PSAT) from Pseudomonas aeruginosa with cofactor Pyridoxal Phosphate and bound Glutamate to be published
4XND	Crystal Structure of E. coli Aminopeptidase N in complex with L-Beta Homotryptophan Descriptor: (3S)-3-AMINO-4-(1H-INDOL-3-YL)BUTANOIC ACID, Aminopeptidase N, GLYCEROL, ... Authors: Addlagatta, A, Gumpena, R. Deposit date: 2015-01-15 Release date: 2016-03-02 Last modified: 2023-11-15 Method: X-RAY DIFFRACTION (1.93 Å) Cite: Crystal Structure of E. coli Aminopeptidase N in complex with L-Beta Homotryptophan To Be Published
4XMU	Crystal Structure of Met260Ala mutant of E. coli Aminopeptidase N in complex with L-Alanine Descriptor: ALANINE, Aminopeptidase N, GLYCEROL, ... Authors: Addlagatta, A, Gumpena, R, Kishor, C. Deposit date: 2015-01-15 Release date: 2016-03-02 Last modified: 2023-11-08 Method: X-RAY DIFFRACTION (2.91 Å) Cite: Crystal Structure of Met260Ala mutant of E. coli Aminopeptidase N To Be Published
4XMZ	Crystal Structure of Met260Ala mutant of E. coli Aminopeptidase N in complex with 2,4-diaminobutyric acid Descriptor: 2,4-DIAMINOBUTYRIC ACID, Aminopeptidase N, GLYCEROL, ... Authors: Addlagatta, A, Gumpena, R. Deposit date: 2015-01-15 Release date: 2016-01-27 Last modified: 2023-11-08 Method: X-RAY DIFFRACTION (2.15 Å) Cite: Crystal Structure of Met260Ala mutant of E. coli Aminopeptidase N in complex with 2,4-diaminobutyric acid To Be Published
4XO7	Crystal structure of human 3-alpha hydroxysteroid dehydrogenase type 3 in complex with NADP+, 5alpha-androstan-3,17-dione and (3beta, 5alpha)-3-hydroxyandrostan-17-one Descriptor: 4-ANDROSTENE-3-17-DIONE, Aldo-keto reductase family 1 member C2, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ... Authors: Zhang, B, Hu, X.-J, Lin, S.-X. Deposit date: 2015-01-16 Release date: 2016-02-17 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (1.75 Å) Cite: Human 3 alpha-hydroxysteroid dehydrogenase type 3: structural clues of 5 alpha-DHT reverse binding and enzyme down-regulation decreasing MCF7 cell growth. Biochem.J., 473, 2016
4XN9	Crystal Structure of E. coli Aminopeptidase N in complex with Beta Alanine Descriptor: Aminopeptidase N, BETA-ALANINE, MALONATE ION, ... Authors: Addlagatta, A, Gumpena, R. Deposit date: 2015-01-15 Release date: 2016-03-02 Last modified: 2023-11-08 Method: X-RAY DIFFRACTION (2.8 Å) Cite: Crystal Structure of E. coli Aminopeptidase N in complex with Beta Alanine To Be Published
4XP5	X-ray structure of Drosophila dopamine transporter bound to cocaine analogue-RTI55 Descriptor: 1-ETHOXY-2-(2-ETHOXYETHOXY)ETHANE, Antibody fragment heavy chain-protein, 9D5-heavy chain, ... Authors: Gouaux, E, Penmatsa, A, Wang, K. Deposit date: 2015-01-16 Release date: 2015-05-06 Last modified: 2020-07-29 Method: X-RAY DIFFRACTION (3.3 Å) Cite: Neurotransmitter and psychostimulant recognition by the dopamine transporter. Nature, 521, 2015
4XPB	X-ray structure of Drosophila dopamine transporter with subsiteB mutations (D121G/S426M) bound to cocaine Descriptor: Antibody fragment heavy chain-protein, 9D5-heavy chain, Antibody fragment light chain-protein, ... Authors: Aravind, P, Wang, K, Gouaux, E. Deposit date: 2015-01-16 Release date: 2015-05-13 Last modified: 2020-07-29 Method: X-RAY DIFFRACTION (3.05 Å) Cite: Neurotransmitter and psychostimulant recognition by the dopamine transporter. Nature, 521, 2015
4XPT	X-ray structure of Drosophila dopamine transporter with subsiteB mutations D121G/S426M and EL2 deletion of 162-201 in complex with substrate analogue 3,4 dichlorophen ethylamine Descriptor: 2-(3,4-dichlorophenyl)ethanamine, 2-acetamido-2-deoxy-beta-D-glucopyranose, CHLORIDE ION, ... Authors: Aravind, P, Wang, K, Gouaux, E. Deposit date: 2015-01-17 Release date: 2015-05-06 Last modified: 2023-09-27 Method: X-RAY DIFFRACTION (3.36 Å) Cite: Neurotransmitter and psychostimulant recognition by the dopamine transporter. Nature, 521, 2015
4XQ9	Crystal Structure of the Homospermidine Synthase (HSS) from Blastochloris viridis in Complex with NAD Descriptor: ACETATE ION, Homospermidine synthase, NICOTINAMIDE-ADENINE-DINUCLEOTIDE Authors: Krossa, S. Deposit date: 2015-01-19 Release date: 2016-01-27 Last modified: 2024-01-10 Method: X-RAY DIFFRACTION (1.6 Å) Cite: Comprehensive Structural Characterization of the Bacterial Homospermidine Synthase-an Essential Enzyme of the Polyamine Metabolism. Sci Rep, 6, 2016
4PEW	Structure of sacteLam55A from Streptomyces sp. SirexAA-E Descriptor: 1,2-ETHANEDIOL, MAGNESIUM ION, Putative secreted protein Authors: Bianchetti, C.M, Takasuka, T.E, Bergeman, L.F, Fox, B.G. Deposit date: 2014-04-25 Release date: 2015-03-18 Last modified: 2023-12-27 Method: X-RAY DIFFRACTION (1.51 Å) Cite: Active site and laminarin binding in glycoside hydrolase family 55. J.Biol.Chem., 290, 2015

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