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3LRP
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BU of 3lrp by Molmil
Crystal Structure of Plasmodium falciparum ADP-Ribosylation Factor 1
Descriptor: ADP-ribosylation factor 1, GUANOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, ...
Authors:Cook, W.J, Chattopadhyay, D.
Deposit date:2010-02-11
Release date:2010-11-10
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structure of Plasmodium falciparum ADP-ribosylation factor 1.
Acta Crystallogr.,Sect.F, 66, 2010
5HAN
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BU of 5han by Molmil
Structure function studies of R. palustris RubisCO (S59F mutant; CABP-bound)
Descriptor: 2-CARBOXYARABINITOL-1,5-DIPHOSPHATE, MAGNESIUM ION, Ribulose bisphosphate carboxylase
Authors:Arbing, M.A, Leong, J.G, Varaljay, V.A, Satagopan, S, North, J.A, Tabita, F.R.
Deposit date:2015-12-30
Release date:2017-01-04
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (2.04 Å)
Cite:Structure function studies of R. palustris RubisCO
To Be Published
3LAX
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BU of 3lax by Molmil
The crystal structure of a domain of phenylacetate-coenzyme A ligase from Bacteroides vulgatus ATCC 8482
Descriptor: Phenylacetate-coenzyme A ligase
Authors:Tan, K, Wu, R, Cobb, G, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
Deposit date:2010-01-07
Release date:2010-01-19
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.428 Å)
Cite:The crystal structure of a domain of phenylacetate-coenzyme A ligase from Bacteroides vulgatus ATCC 8482
To be Published
5HZH
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BU of 5hzh by Molmil
Crystal structure of photoinhibitable Rac1 containing C450A mutant LOV2 domain
Descriptor: CALCIUM ION, FLAVIN MONONUCLEOTIDE, GUANOSINE-5'-TRIPHOSPHATE, ...
Authors:Tarnawski, M, Dagliyan, O, Chu, P.H, Shirvanyants, D, Dokholyan, N.V, Hahn, K.M, Schlichting, I.
Deposit date:2016-02-02
Release date:2016-12-21
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Engineering extrinsic disorder to control protein activity in living cells.
Science, 354, 2016
5HE3
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BU of 5he3 by Molmil
Bovine GRK2 in complex with Gbetagamma subunits and CCG224411
Descriptor: (4~{S})-4-[3-[2-(2,6-dimethylphenyl)ethylcarbamoyl]-4-fluoranyl-phenyl]-~{N}-(1~{H}-indazol-5-yl)-6-methyl-2-oxidanylidene-3,4-dihydro-1~{H}-pyrimidine-5-carboxamide, Beta-adrenergic receptor kinase 1, Guanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2, ...
Authors:Cato, M.C, Tesmer, J.J.G.
Deposit date:2016-01-05
Release date:2016-05-11
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (2.74 Å)
Cite:Structure-Based Design, Synthesis, and Biological Evaluation of Highly Selective and Potent G Protein-Coupled Receptor Kinase 2 Inhibitors.
J.Med.Chem., 59, 2016
3LB0
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BU of 3lb0 by Molmil
Crystal Structure of the 3-Dehydroquinate Dehydratase (aroD) from Salmonella typhimurium LT2 with Citrate Bound to the Active Site.
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 3-dehydroquinate dehydratase, CITRIC ACID, ...
Authors:Minasov, G, Light, S.H, Shuvalova, L, Papazisi, L, Anderson, W.F, Center for Structural Genomics of Infectious Diseases (CSGID)
Deposit date:2010-01-07
Release date:2010-01-26
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:Crystal Structure of the 3-Dehydroquinate Dehydratase (aroD) from Salmonella typhimurium LT2 with Citrate Bound to the Active Site.
TO BE PUBLISHED
5HZQ
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BU of 5hzq by Molmil
Crystal structure of cellular retinoic acid binding protein 2 (CRABP2)-aryl fluorosulfate covalent conjugate
Descriptor: 4'-[(3,6,9,12-tetraoxapentadec-14-yn-1-yl)oxy][1,1'-biphenyl]-4-yl sulfurofluoridate, Cellular retinoic acid-binding protein 2, GLYCEROL
Authors:Chen, W, Mortenson, D.E, Wilson, I.A, Kelly, J.W.
Deposit date:2016-02-02
Release date:2016-06-01
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Arylfluorosulfates Inactivate Intracellular Lipid Binding Protein(s) through Chemoselective SuFEx Reaction with a Binding Site Tyr Residue.
J.Am.Chem.Soc., 138, 2016
5HEL
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BU of 5hel by Molmil
Crystal structure of the N-terminus Y153H bromodomain mutant of human BRD2
Descriptor: 1,2-ETHANEDIOL, Bromodomain-containing protein 2
Authors:Tallant, C, Lori, C, Pasquo, A, Chiaraluce, R, Consalvi, V, Newman, J.A, von Delft, F, Arrowsmith, C.H, Edwards, A.M, Bountra, C, Knapp, S.
Deposit date:2016-01-06
Release date:2016-01-20
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.45 Å)
Cite:Crystal structure of the N-terminus Y153H bromodomain mutant of human BRD2
To Be Published
3LBK
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BU of 3lbk by Molmil
Structure of human MDM2 protein in complex with a small molecule inhibitor
Descriptor: 6-chloro-3-[1-(4-chlorobenzyl)-4-phenyl-1H-imidazol-5-yl]-1H-indole-2-carboxylic acid, E3 ubiquitin-protein ligase Mdm2, SULFATE ION
Authors:Popowicz, G.M, Czarna, A, Wolf, S, Holak, T.A.
Deposit date:2010-01-08
Release date:2010-03-16
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Structures of low molecular weight inhibitors bound to MDMX and MDM2 reveal new approaches for p53-MDMX/MDM2 antagonist drug discovery
Cell Cycle, 9, 2010
5HLJ
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BU of 5hlj by Molmil
Crystal Structure of Major Envelope Protein VP24 from White Spot Syndrome Virus
Descriptor: VP24
Authors:Sun, L.F, Su, Y.T, Zhao, Y.H, Fu, Z.Q, Wu, Y.K.
Deposit date:2016-01-15
Release date:2016-09-14
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (2.406 Å)
Cite:Crystal Structure of Major Envelope Protein VP24 from White Spot Syndrome Virus
Sci Rep, 6, 2016
5HEO
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BU of 5heo by Molmil
Pentameric ligand-gated ion channel ELIC mutant P254G
Descriptor: Gamma-aminobutyric-acid receptor subunit beta-1
Authors:Bertozzi, C, Dutzler, R.
Deposit date:2016-01-06
Release date:2016-03-02
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (3.3 Å)
Cite:Signal Transduction at the Domain Interface of Prokaryotic Pentameric Ligand-Gated Ion Channels.
Plos Biol., 14, 2016
7N5B
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BU of 7n5b by Molmil
Structure of AtAtm3 in the outward-facing conformation
Descriptor: ABC transporter B family member 25, mitochondrial, ADENOSINE-5'-DIPHOSPHATE, ...
Authors:Fan, C, Rees, D.C.
Deposit date:2021-06-05
Release date:2022-04-13
Last modified:2024-05-29
Method:ELECTRON MICROSCOPY (3.8 Å)
Cite:Glutathione binding to the plant At Atm3 transporter and implications for the conformational coupling of ABC transporters.
Elife, 11, 2022
3LBO
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BU of 3lbo by Molmil
Human aldose reductase mutant T113C complexed with IDD594
Descriptor: Aldose reductase, BROMIDE ION, CITRIC ACID, ...
Authors:Koch, C, Heine, A, Klebe, G.
Deposit date:2010-01-08
Release date:2010-12-15
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (1.1 Å)
Cite:Tracing the detail: how mutations affect binding modes and thermodynamic signatures of closely related aldose reductase inhibitors
J.Mol.Biol., 406, 2011
5HG0
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BU of 5hg0 by Molmil
Crystal Structure of Pantoate-beta-alanine Ligase from Francisella tularensis complex with SAM
Descriptor: Pantothenate synthetase, S-ADENOSYLMETHIONINE
Authors:Chang, C, Maltseva, N, Kim, Y, Papazisi, L, Anderson, W.F, Joachimiak, A, Center for Structural Genomics of Infectious Diseases (CSGID)
Deposit date:2016-01-07
Release date:2016-01-20
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Crystal Structure of Pantoate-beta-alanine Ligase from Francisella tularensis complex with SAM
To Be Published
3L65
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BU of 3l65 by Molmil
Xenobiotic Reductase A - C25A Mutant
Descriptor: (R,R)-2,3-BUTANEDIOL, FLAVIN MONONUCLEOTIDE, SULFATE ION, ...
Authors:Spiegelhauer, O, Dobbek, H.
Deposit date:2009-12-23
Release date:2010-03-23
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (1.2 Å)
Cite:Cysteine as a modulator residue in the active site of xenobiotic reductase A: a structural, thermodynamic and kinetic study
J.Mol.Biol., 398, 2010
5HGH
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BU of 5hgh by Molmil
HLA*A2402 complexed with HIV nef138 10mer epitope
Descriptor: Beta-2-microglobulin, HLA class I histocompatibility antigen, A-24 alpha chain, ...
Authors:Shi, Y, Qi, J, Gao, G.F.
Deposit date:2016-01-08
Release date:2016-06-08
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2.392 Å)
Cite:Effects of a Single Escape Mutation on T Cell and HIV-1 Co-adaptation.
Cell Rep, 15, 2016
7N58
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BU of 7n58 by Molmil
Structure of AtAtm3 in the inward-facing conformation
Descriptor: ABC transporter B family member 25, mitochondrial
Authors:Fan, C, Rees, D.C.
Deposit date:2021-06-05
Release date:2022-04-13
Last modified:2024-05-29
Method:ELECTRON MICROSCOPY (3.4 Å)
Cite:Glutathione binding to the plant At Atm3 transporter and implications for the conformational coupling of ABC transporters.
Elife, 11, 2022
3LC9
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BU of 3lc9 by Molmil
Ricin A-chain variant 1-33/44-198 with engineered disulfide bond
Descriptor: Ricin A chain, SULFATE ION
Authors:Compton, J.R, Legler, P.M, Millard, C.B.
Deposit date:2010-01-10
Release date:2010-11-10
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.28 Å)
Cite:Introduction of a disulfide bond leads to stabilization and crystallization of a ricin immunogen.
Proteins, 79, 2011
5HGO
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BU of 5hgo by Molmil
Hexameric HIV-1 CA R18G mutant
Descriptor: Capsid protein P24
Authors:Jacques, D.A, James, L.C.
Deposit date:2016-01-08
Release date:2016-08-10
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2 Å)
Cite:HIV-1 uses dynamic capsid pores to import nucleotides and fuel encapsidated DNA synthesis.
Nature, 536, 2016
3L74
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BU of 3l74 by Molmil
Cytochrome BC1 complex from chicken with famoxadone bound
Descriptor: 1,2-dioleoyl-sn-glycero-3-phosphoethanolamine, AZIDE ION, CARDIOLIPIN, ...
Authors:Huang, L, Berry, E.A.
Deposit date:2009-12-28
Release date:2010-02-02
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.76 Å)
Cite:Famoxadone and related inhibitors bind like methoxy acrylate inhibitors in the Qo site of the BC1 compl and fix the rieske iron-sulfur protein in a positio close to but distinct from that seen with stigmatellin and other "DISTAL" Qo inhibitors.
To be Published
5HLO
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BU of 5hlo by Molmil
Crystal structure of calcium and zinc-bound human S100A8 in space group C2221
Descriptor: ACETATE ION, CACODYLATE ION, CALCIUM ION, ...
Authors:Lin, H, Andersen, G.R, Yatime, L.
Deposit date:2016-01-15
Release date:2016-06-08
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Crystal structure of human S100A8 in complex with zinc and calcium.
Bmc Struct.Biol., 16, 2016
3LCI
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BU of 3lci by Molmil
The D-sialic acid aldolase mutant V251W
Descriptor: N-acetylneuraminate lyase, SULFATE ION
Authors:Chou, C.-Y, Wang, A.H.-J, Ko, T.-P.
Deposit date:2010-01-11
Release date:2011-01-19
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (2.12 Å)
Cite:Modulation of substrate specificities of D-sialic acid aldolase through single mutations of Val251
To be Published
6OYE
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BU of 6oye by Molmil
Crystal structure of Y99F mutant of human macrophage migration inhibitory factor
Descriptor: GLYCEROL, ISOPROPYL ALCOHOL, Macrophage migration inhibitory factor, ...
Authors:Pantouris, G, Lolis, E.
Deposit date:2019-05-14
Release date:2020-04-29
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (1.53 Å)
Cite:Regulation of MIF Enzymatic Activity by an Allosteric Site at the Central Solvent Channel.
Cell Chem Biol, 27, 2020
5HGX
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BU of 5hgx by Molmil
Crystal Structure of Transketolase mutant - H261F from Pichia Stipitis
Descriptor: PENTAETHYLENE GLYCOL, Transketolase
Authors:Li, T.L, Hsu, L.J, Hsu, N.S.
Deposit date:2016-01-09
Release date:2017-01-25
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (1.09 Å)
Cite:Structural and biochemical interrogation on transketolase from Pichia stipitis for new functionality
Protein Eng. Des. Sel., 2016
3L7Y
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BU of 3l7y by Molmil
The Crystal Structure of SMU.1108c from Streptococcus mutans UA159
Descriptor: MAGNESIUM ION, Putative uncharacterized protein smu.1108c
Authors:Su, X.-D, Feng, M.J, Liu, X.
Deposit date:2009-12-29
Release date:2010-12-08
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (1.996 Å)
Cite:The Crystal Structure of SMU.1108c from Streptococcus mutans UA159
TO BE PUBLISHED

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