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3L3N	Testis ACE co-crystal structure with novel inhibitor lisW Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, Angiotensin-converting enzyme, CHLORIDE ION, ... Authors: Watermeyer, J.M, Kroger, W.L, O'Neil, H.G, Sewell, B.T, Sturrock, E.D. Deposit date: 2009-12-17 Release date: 2010-04-28 Last modified: 2023-09-06 Method: X-RAY DIFFRACTION (2.3 Å) Cite: Characterization of domain-selective inhibitor binding in angiotensin-converting enzyme using a novel derivative of lisinopril. Biochem.J., 428, 2010
3KM6	Crystal Structure of the Human GST Pi C47S/Y108V Double Mutant in Complex with the Ethacrynic Acid-Glutathione Conjugate Descriptor: CALCIUM ION, ETHACRYNIC ACID, GLUTATHIONE, ... Authors: Parker, L.J. Deposit date: 2009-11-10 Release date: 2010-03-23 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (2.1 Å) Cite: Diuretic drug binding to human glutathione transferase P1-1: potential role of Cys-101 revealed in the double mutant C47S/Y108V. J.Mol.Recognit., 24
3KN1	Crystal Structure of Golgi Phosphoprotein 3 N-term Truncation Variant Descriptor: Golgi phosphoprotein 3, SULFATE ION Authors: Schmitz, K.R, Bessman, N.J, Setty, T.G, Ferguson, K.M. Deposit date: 2009-11-11 Release date: 2009-12-15 Last modified: 2023-11-22 Method: X-RAY DIFFRACTION (2.9 Å) Cite: PtdIns4P recognition by Vps74/GOLPH3 links PtdIns 4-kinase signaling to retrograde Golgi trafficking. J.Cell Biol., 187, 2009
3KOB	DTD from Plasmodium falciparum in complex with D-Glutamic acid Descriptor: D-GLUTAMIC ACID, D-tyrosyl-tRNA(Tyr) deacylase Authors: Manickam, Y, Bhatt, T.K, Sharma, A. Deposit date: 2009-11-13 Release date: 2009-12-08 Last modified: 2024-03-20 Method: X-RAY DIFFRACTION (2.99 Å) Cite: Ligand-bound Structures Provide Atomic Snapshots for the Catalytic Mechanism of D-Amino Acid Deacylase J.Biol.Chem., 285, 2010
3KHC	Crystal Structure of Escherichia coli AlkB in complex with ssDNA containing a 1-methylguanine lesion Descriptor: 2-OXOGLUTARIC ACID, Alpha-ketoglutarate-dependent dioxygenase alkB, COBALT (II) ION, ... Authors: Hollis, T, Holland, P.J. Deposit date: 2009-10-30 Release date: 2010-01-12 Last modified: 2023-09-06 Method: X-RAY DIFFRACTION (2.2 Å) Cite: Structural and mutational analysis of Escherichia coli AlkB provides insight into substrate specificity and DNA damage searching. Plos One, 5, 2010
3KK2	HIV-1 reverse transcriptase-DNA complex with dATP bound in the nucleotide binding site Descriptor: 2'-DEOXYADENOSINE 5'-TRIPHOSPHATE, 5'-D(*A*TP*GP*GP*TP*GP*GP*GP*CP*GP*CP*CP*CP*GP*AP*AP*CP*AP*GP*GP*GP*AP*CP*TP*GP*TP*G)-3', 5'-D(*AP*CP*A*GP*TP*CP*CP*CP*TP*GP*TP*TP*CP*GP*GP*GP*CP*GP*CP*CP*(DOC))-3', ... Authors: Lansdon, E.B. Deposit date: 2009-11-04 Release date: 2010-03-23 Last modified: 2023-09-06 Method: X-RAY DIFFRACTION (2.9 Å) Cite: Visualizing the molecular interactions of a nucleotide analog, GS-9148, with HIV-1 reverse transcriptase-DNA complex. J.Mol.Biol., 397, 2010
3KO4	Crystal structure of D-Tyr-tRNA(Tyr) deacylase from Plasmodium falciparum in complex with ADP Descriptor: ADENOSINE-5'-DIPHOSPHATE, D-tyrosyl-tRNA(Tyr) deacylase Authors: Manickam, Y, Bhatt, T.K, Sharma, A. Deposit date: 2009-11-13 Release date: 2009-12-01 Last modified: 2024-04-03 Method: X-RAY DIFFRACTION (2.7 Å) Cite: Ligand-bound Structures Provide Atomic Snapshots for the Catalytic Mechanism of D-Amino Acid Deacylase J.Biol.Chem., 285, 2010
3KOC	DTD from Plasmodium falciparum in complex with D-Histidine Descriptor: D-HISTIDINE, D-tyrosyl-tRNA(Tyr) deacylase Authors: Manickam, Y, Bhatt, T.K, Sharma, A. Deposit date: 2009-11-13 Release date: 2009-12-08 Last modified: 2024-03-20 Method: X-RAY DIFFRACTION (2.91 Å) Cite: Ligand-bound Structures Provide Atomic Snapshots for the Catalytic Mechanism of D-Amino Acid Deacylase J.Biol.Chem., 285, 2010
3L0P	Crystal structures of Iron containing Adenylate kinase from Desulfovibrio gigas Descriptor: Adenylate kinase, FE (III) ION, GLYCEROL Authors: Mukhopadhyay, A, Trincao, J, Romao, M.J. Deposit date: 2009-12-10 Release date: 2010-12-15 Last modified: 2024-03-20 Method: X-RAY DIFFRACTION (3 Å) Cite: Crystal structure of the zinc-, cobalt-, and iron-containing adenylate kinase from Desulfovibrio gigas: a novel metal-containing adenylate kinase from Gram-negative bacteria J.Biol.Inorg.Chem., 16, 2011
3KLI	Crystal structure of unliganded AZT-resistant HIV-1 Reverse Transcriptase Descriptor: Reverse transcriptase/ribonuclease H, p51 RT Authors: Tu, X, Sarafianos, S.G, Arnold, E. Deposit date: 2009-11-08 Release date: 2010-09-22 Last modified: 2023-09-06 Method: X-RAY DIFFRACTION (2.65 Å) Cite: Structural basis of HIV-1 resistance to AZT by excision. Nat.Struct.Mol.Biol., 17, 2010
3KNF	Crystal structure of D-Tyr-tRNA(Tyr) deacylase from Plasmodium falciparum Descriptor: D-tyrosyl-tRNA(Tyr) deacylase Authors: Manickam, Y, Bhatt, T.K, Sharma, A. Deposit date: 2009-11-12 Release date: 2009-12-01 Last modified: 2024-04-03 Method: X-RAY DIFFRACTION (3 Å) Cite: Ligand-bound Structures Provide Atomic Snapshots for the Catalytic Mechanism of D-Amino Acid Deacylase J.Biol.Chem., 285, 2010
2L8S	Solution NMR Structure of Transmembrane and Cytosolic Regions of Integrin Alpha1 in Detergent Micelles Descriptor: Integrin alpha-1 Authors: Lai, C, Liu, X, Tian, C. Deposit date: 2011-01-24 Release date: 2012-02-01 Last modified: 2024-05-15 Method: SOLUTION NMR Cite: Integrin Alpha1 Has a Long Helix, Extending from the Transmembrane Region to the Cytoplasmic Tail in Detergent Micelles Plos One, 8, 2013
4B1Y	Structure of the Phactr1 RPEL-3 bound to G-actin Descriptor: ACTIN, ALPHA SKELETAL MUSCLE, ADENOSINE-5'-TRIPHOSPHATE, ... Authors: Mouilleron, S, Wiezlak, M, O'Reilly, N, Treisman, R, McDonald, N.Q. Deposit date: 2012-07-12 Release date: 2013-07-31 Last modified: 2023-12-20 Method: X-RAY DIFFRACTION (1.29 Å) Cite: Structures of the Phactr1 RPEL domain and RPEL motif complexes with G-actin reveal the molecular basis for actin binding cooperativity. Structure, 20, 2012
6REQ	METHYLMALONYL-COA MUTASE, 3-CARBOXYPROPYL-COA INHIBITOR COMPLEX Descriptor: 3-CARBOXYPROPYL-COENZYME A, COBALAMIN, GLYCEROL, ... Authors: Evans, P.R, Mancia, F. Deposit date: 1998-09-03 Release date: 1999-09-09 Last modified: 2023-09-20 Method: X-RAY DIFFRACTION (2.2 Å) Cite: Crystal structure of substrate complexes of methylmalonyl-CoA mutase. Biochemistry, 38, 1999
4B8E	PRY-SPRY domain of Trim25 Descriptor: 1,2-ETHANEDIOL, CHLORIDE ION, E3 UBIQUITIN/ISG15 LIGASE TRIM25 Authors: Kershaw, N.J, D'Cruz, A.A, Nicola, N.A, Nicholson, S.E, Babon, J.J. Deposit date: 2012-08-27 Release date: 2013-09-04 Last modified: 2023-12-20 Method: X-RAY DIFFRACTION (1.779 Å) Cite: Crystal Structure of the Trim25 B30.2 (Pryspry) Domain: A Key Component of Antiviral Signaling. Biochem.J., 456, 2013
3DAW	Structure of the actin-depolymerizing factor homology domain in complex with actin Descriptor: ADENOSINE-5'-TRIPHOSPHATE, Actin, alpha skeletal muscle, ... Authors: Paavilainen, V.O, Oksanen, E, Goldman, A, Lappalainen, P. Deposit date: 2008-05-30 Release date: 2008-07-29 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (2.55 Å) Cite: Structure of the actin-depolymerizing factor homology domain in complex with actin J.Cell Biol., 182, 2008
6R2W	Crystal structure of the super-active FVIIa variant VYT in complex with tissue factor Descriptor: CALCIUM ION, Coagulation factor VII, N-acetyl-D-phenylalanyl-N-[(2S,3S)-6-carbamimidamido-1-chloro-2-hydroxyhexan-3-yl]-L-phenylalaninamide, ... Authors: Sorensen, A.B, Svensson, L.A, Gandhi, P.S. Deposit date: 2019-03-19 Release date: 2019-12-11 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (1.25 Å) Cite: Beating tissue factor at its own game: Design and properties of a soluble tissue factor-independent coagulation factor VIIa. J.Biol.Chem., 295, 2020
4B98	The structure of the omega aminotransferase from Pseudomonas aeruginosa Descriptor: 3-[O-PHOSPHONOPYRIDOXYL]--AMINO-BENZOIC ACID, BETA-ALANINE--PYRUVATE TRANSAMINASE, CALCIUM ION, ... Authors: Sayer, C, Isupov, M.N, Westlake, A, Littlechild, J.A. Deposit date: 2012-09-03 Release date: 2013-03-27 Last modified: 2023-12-20 Method: X-RAY DIFFRACTION (1.65 Å) Cite: Structural Studies with Pseudomonas and Chromobacterium [Omega]-Aminotransferases Provide Insights Into Their Differing Substrate Specificity. Acta Crystallogr.,Sect.D, 69, 2013
6R5K	Cryo-EM structure of a poly(A) RNP bound to the Pan2-Pan3 deadenylase Descriptor: MAGNESIUM ION, PAN2-PAN3 deadenylation complex catalytic subunit PAN2, PAN2-PAN3 deadenylation complex subunit PAN3, ... Authors: Schaefer, I.B, Conti, E. Deposit date: 2019-03-25 Release date: 2019-05-29 Last modified: 2024-05-15 Method: ELECTRON MICROSCOPY (4.8 Å) Cite: Molecular Basis for poly(A) RNP Architecture and Recognition by the Pan2-Pan3 Deadenylase. Cell, 177, 2019
6R6V	Structure of recombinant human butyrylcholinesterase in complex with a fluorescent coumarin-based probe Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, Cholinesterase, ... Authors: Brazzolotto, X, Nachon, F, Knez, D, Gobec, S. Deposit date: 2019-03-28 Release date: 2020-01-15 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (2.5 Å) Cite: Development of potent reversible selective inhibitors of butyrylcholinesterase as fluorescent probes. J Enzyme Inhib Med Chem, 35, 2020
4BHW	Structural basis for autoinhibition of the acetyltransferase activity of p300 Descriptor: HISTONE ACETYLTRANSFERASE P300, ZINC ION, [(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]methyl (3R,20R)-20-carbamoyl-3-hydroxy-2,2-dimethyl-4,8,14,22-tetraoxo-12-thia-5,9,15,21-tetraazatricos-1-yl dihydrogen diphosphate Authors: Delvecchio, M, Gaucher, J, Aguilar-Gurrieri, C, Ortega, E, Panne, D. Deposit date: 2013-04-08 Release date: 2013-08-14 Last modified: 2023-12-20 Method: X-RAY DIFFRACTION (2.799 Å) Cite: Structure of the P300 Catalytic Core and Implications for Chromatin Targeting and Hat Regulation Nat.Struct.Mol.Biol., 20, 2013
6R81	Multidrug resistance transporter BmrA mutant E504A bound with ATP and Mg solved by Cryo-EM Descriptor: ADENOSINE-5'-TRIPHOSPHATE, Lipid A export ATP-binding/permease protein MsbA, MAGNESIUM ION Authors: Wiseman, B, Chaptal, V, Zampieri, V, Magnard, S, Hogbom, M, Falson, P. Deposit date: 2019-03-30 Release date: 2020-05-06 Last modified: 2024-07-10 Method: ELECTRON MICROSCOPY (3.9 Å) Cite: Substrate-bound and substrate-free outward-facing structures of a multidrug ABC exporter. Sci Adv, 8, 2022
4BLI	Galectin-3c in complex with Bisamido-thiogalactoside derivate 1 Descriptor: (3-Deoxy-3-(3-methoxy-benzamido)-b-D-galactopyranosyl)-(3-deoxy-3-(3-methoxy-benzamido)-2-O-sulfo-b-D-galactopyranosyl)-sulfide, GALECTIN-3 Authors: Noresson, A.L, Oberg, C.T, Engstrom, O, Hakansson, M, Logan, D.T, Leffler, H, Nilsson, U.J. Deposit date: 2013-05-03 Release date: 2014-05-21 Last modified: 2023-12-20 Method: X-RAY DIFFRACTION (1.08 Å) Cite: Controlling Protein Conformation Through Electronic Fine-Tuning of Arginine-Arene Interactions: Synthetic, Structural, and Biological Studies To be Published
2LK1	Solution structure and binding studies of the RanBP2-type zinc finger of RBM5 Descriptor: 9,10-dioxo-9,10-dihydroanthracene-2-sulfonic acid, RNA-binding protein 5, ZINC ION Authors: Farina, B, Pellecchia, M. Deposit date: 2011-09-30 Release date: 2011-12-28 Method: SOLUTION NMR Cite: Targeting Zinc Finger Domains with Small Molecules: Solution Structure and Binding Studies of the RanBP2-Type Zinc Finger of RBM5. Chembiochem, 12, 2011
2LAX	Structure of first WW domain of human YAP in complex with a human Smad1 doubly-phosphorilated derived peptide. Descriptor: Mothers against decapentaplegic homolog 1, Yorkie homolog Authors: Macias, M.J, Aragon, E, Goerner, N, Zaromytidou, A, Xi, Q, Escobedo, A, Massague, J. Deposit date: 2011-03-22 Release date: 2011-07-06 Last modified: 2011-07-13 Method: SOLUTION NMR Cite: A Smad action turnover switch operated by WW domain readers of a phosphoserine code. Genes Dev., 25, 2011

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