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3PJD
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BU of 3pjd by Molmil
Structure of ENR G93A mutant-NAD+-Triclosan complex
分子名称: Enoyl-[acyl-carrier-protein] reductase [NADH], NICOTINAMIDE-ADENINE-DINUCLEOTIDE, TRICLOSAN
著者Kim, H.T, Shin, D.G, Chang, H.J.
登録日2010-11-10
公開日2011-04-20
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Structural basis of triclosan resistance
J.Struct.Biol., 174, 2011
6NLR
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BU of 6nlr by Molmil
Crystal structure of the putative histidinol phosphatase hisK from Listeria monocytogenes with trinuclear metals determined by PIXE revealing sulphate ion in active site. Based on PIXE analysis and original date from 3DCP
分子名称: CALCIUM ION, COBALT (II) ION, FE (III) ION, ...
著者Snell, E.H, Garman, E.F, Lowe, E.D.
登録日2019-01-09
公開日2019-12-25
最終更新日2020-01-22
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献High-Throughput PIXE as an Essential Quantitative Assay for Accurate Metalloprotein Structural Analysis: Development and Application.
J.Am.Chem.Soc., 142, 2020
3PXR
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BU of 3pxr by Molmil
Apo CDK2 crystallized from Jeffamine
分子名称: 1,2-ETHANEDIOL, Cell division protein kinase 2
著者Betzi, S, Alam, R, Schonbrunn, E.
登録日2010-12-10
公開日2011-02-16
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Discovery of a Potential Allosteric Ligand Binding Site in CDK2.
Acs Chem.Biol., 6, 2011
3PY0
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BU of 3py0 by Molmil
CDK2 in complex with inhibitor SU9516
分子名称: (3Z)-3-(1H-IMIDAZOL-5-YLMETHYLENE)-5-METHOXY-1H-INDOL-2(3H)-ONE, 1,2-ETHANEDIOL, Cell division protein kinase 2, ...
著者Betzi, S, Alam, R, Schonbrunn, E.
登録日2010-12-10
公開日2011-02-16
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (1.75 Å)
主引用文献Discovery of a Potential Allosteric Ligand Binding Site in CDK2.
Acs Chem.Biol., 6, 2011
3PR3
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BU of 3pr3 by Molmil
Crystal structure of Plasmodium falciparum glucose-6-phosphate isomerase (PF14_0341) in complex with fructose-6-phosphate
分子名称: 6-O-phosphono-beta-D-fructofuranose, Glucose-6-phosphate isomerase, PHOSPHATE ION
著者Gileadi, T, Wernimont, A.K, Hutchinson, A, Weadge, J, Cossar, D, Lew, J, Arrowsmith, C.H, Edwards, A.M, Bountra, C, Weigelt, J, Hui, R, Hills, T, Pizarro, J.C, Structural Genomics Consortium (SGC)
登録日2010-11-29
公開日2011-02-09
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (2.45 Å)
主引用文献Crystal structure of Plasmodium falciparum glucose-6-phosphate isomerase (PF14_0341) in complex with fructose-6-phosphate
To be Published
3PS3
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BU of 3ps3 by Molmil
Crystal structure of the Escherichia Coli LPXC/LPC-053 complex
分子名称: 4-[4-(4-aminophenyl)buta-1,3-diyn-1-yl]-N-[(2S,3S)-3-hydroxy-1-nitroso-1-oxobutan-2-yl]benzamide, 4-ethynyl-N-[(1S,2R)-2-hydroxy-1-(oxocarbamoyl)propyl]benzamide, DIMETHYL SULFOXIDE, ...
著者Lee, C.-J, Zhou, P.
登録日2010-11-30
公開日2011-01-19
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Syntheses, structures and antibiotic activities of LpxC inhibitors based on the diacetylene scaffold.
Bioorg.Med.Chem., 19, 2011
3PU7
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BU of 3pu7 by Molmil
Cu-Zn Tomato Chloroplast Superoxide Dismutase
分子名称: COPPER (II) ION, Superoxide dismutase [Cu-Zn], chloroplastic, ...
著者Galaleldeen, A, Taylor, A.B, Hart, P.J.
登録日2010-12-03
公開日2011-12-21
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Biophysical Properties of Tomato Chloroplast SOD
To be Published
3M1D
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BU of 3m1d by Molmil
Structure of BIR1 from cIAP1
分子名称: Baculoviral IAP repeat-containing protein 2, ZINC ION
著者Mace, P.D, Day, C.L.
登録日2010-03-04
公開日2010-05-26
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Asymmetric recruitment of cIAPs by TRAF2
J.Mol.Biol., 400, 2010
6N5M
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BU of 6n5m by Molmil
Crystal structure of ABIN-1 UBAN in complex with one M1-linked di-ubiquitin
分子名称: Polyubiquitin-C, TNFAIP3-interacting protein 1
著者Rahighi, S, Dikic, I, Wakatsuki, S.
登録日2018-11-22
公開日2019-07-17
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (3.01 Å)
主引用文献Molecular Recognition of M1-Linked Ubiquitin Chains by Native and Phosphorylated UBAN Domains.
J.Mol.Biol., 431, 2019
3STM
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BU of 3stm by Molmil
Structure of human LFABP in complex with one molecule of palmitic acid
分子名称: Fatty acid-binding protein, liver, PALMITIC ACID
著者Sharma, A, Sharma, A.
登録日2011-07-11
公開日2011-08-10
最終更新日2024-03-20
実験手法X-RAY DIFFRACTION (2.216 Å)
主引用文献Fatty acid induced remodeling within the Human liver fatty acid binding protein
J.Biol.Chem., 2011
6N8G
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BU of 6n8g by Molmil
IRAK4 bound to benzoxazole compound
分子名称: Interleukin-1 receptor-associated kinase 4, N-[2-(morpholin-4-yl)-6-(piperidin-1-yl)-1,3-benzoxazol-5-yl]-6-(1H-pyrrolo[2,3-b]pyridin-5-yl)pyridine-2-carboxamide
著者Larsen, N.A, Bloudoff, K, Subramanian, V, Dobrzanska, M, Gluza, K.
登録日2018-11-29
公開日2018-12-12
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献To be published
To Be Published
6N97
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BU of 6n97 by Molmil
Methylmalonyl-CoA decarboxylase in complex with 2-sulfonate-propionyl-amino(dethia)-CoA
分子名称: (2R)-sulfonatepropionyl-amino(dethia)-CoA, (2S)-sulfonatepropionyl-amino(dethia)-CoA, IMIDAZOLE, ...
著者Stunkard, L.M, Dixon, A.D, Huth, T.J, Lohman, J.R.
登録日2018-11-30
公開日2019-04-10
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (1.75 Å)
主引用文献Sulfonate/Nitro Bearing Methylmalonyl-Thioester Isosteres Applied to Methylmalonyl-CoA Decarboxylase Structure-Function Studies.
J. Am. Chem. Soc., 141, 2019
3M0K
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BU of 3m0k by Molmil
Structure of oxaloacetate acetylhydrolase in complex with the product oxalate
分子名称: CALCIUM ION, MANGANESE (II) ION, OXALATE ION, ...
著者Herzberg, O, Chen, C.
登録日2010-03-03
公開日2010-06-16
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Structure of oxalacetate acetylhydrolase, a virulence factor of the chestnut blight fungus.
J.Biol.Chem., 285, 2010
6NCT
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BU of 6nct by Molmil
Structure of p110alpha/niSH2 - vector data collection
分子名称: Phosphatidylinositol 3-kinase regulatory subunit alpha, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform, SULFATE ION, ...
著者Miller, M.S, Maheshwari, S, Amzel, L.M, Gabelli, S.B.
登録日2018-12-12
公開日2019-02-06
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (3.35 Å)
主引用文献Getting the Most Out of Your Crystals: Data Collection at the New High-Flux, Microfocus MX Beamlines at NSLS-II.
Molecules, 24, 2019
3MFQ
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BU of 3mfq by Molmil
A Glance into the Metal Binding Specificity of TroA: Where Elaborate Behaviors Occur in the Active Center
分子名称: High-affinity zinc uptake system protein znuA, ZINC ION
著者Gao, G.F, Zheng, B, Zhang, Q, Gao, J, Han, H, Li, M.
登録日2010-04-03
公開日2011-04-13
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (2.598 Å)
主引用文献Insight into the interaction of metal ions with TroA from Streptococcus suis
Plos One, 6, 2011
3MGT
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BU of 3mgt by Molmil
Crystal structure of a H5-specific CTL epitope variant derived from H5N1 influenza virus in complex with HLA-A*0201
分子名称: 10-meric peptide from Hemagglutinin, Beta-2-microglobulin, HLA class I histocompatibility antigen, ...
著者Sun, Y, Liu, J, Yang, M, Gao, F, Zhou, J, Kitamura, Y.
登録日2010-04-07
公開日2010-05-19
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (2.197 Å)
主引用文献Identification and structural definition of H5-specific CTL epitopes restricted by HLA-A*0201 derived from the H5N1 subtype of influenza A viruses
J.Gen.Virol., 91, 2010
3T4Q
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BU of 3t4q by Molmil
Arabidopsis histidine kinase 4 sensor domain in complex with trans-zeatin riboside (hydrolysed)
分子名称: (2E)-2-methyl-4-(9H-purin-6-ylamino)but-2-en-1-ol, Histidine kinase 4, MALONATE ION
著者Hothorn, M.
登録日2011-07-26
公開日2011-10-05
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Structural basis for cytokinin recognition by Arabidopsis thaliana histidine kinase 4.
Nat.Chem.Biol., 7, 2011
6NEY
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BU of 6ney by Molmil
Crystal structure of TcBDF5, a bromodomain containing protein from Trypanosoma cruzi
分子名称: Uncharacterized protein
著者Loppnau, P, Dong, A, Tempel, W, Lin, Y.H, Bountra, C, Arrowsmith, C.H, Edwards, A.M, Hui, R, Vedadi, M, Harding, R.J, Structural Genomics Consortium (SGC)
登録日2018-12-18
公開日2019-03-20
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (1.68 Å)
主引用文献Crystal structure of TcBDF5, a bromodomain containing protein from Trypanosoma cruzi
To Be Published
6NEZ
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BU of 6nez by Molmil
Trypanosoma brucei - BDF5, Tb427tmp.01.5000 A, solved with PF-CBP1
分子名称: 5-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[2-(morpholin-4-yl)ethyl]-2-[2-(4-propoxyphenyl)ethyl]-1H-benzimidazole, UNKNOWN ATOM OR ION, Uncharacterized protein
著者Lin, Y.H, Dong, A, Tempel, W, McAuley, J, Loppnau, P, Bountra, C, Arrowsmith, C.H, Edwards, A.M, Hui, R, Vedadi, M, Harding, R.J, Structural Genomics Consortium (SGC)
登録日2018-12-18
公開日2019-01-23
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Trypanosoma brucei - BDF5, Tb427tmp.01.5000 A, solved with PF-CBP1
to be published
6NDA
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BU of 6nda by Molmil
RHODOCETIN IN COMPLEX WITH THE INTEGRIN ALPHA2-A DOMAIN AND CADMIUM
分子名称: AMMONIUM ION, CADMIUM ION, CHLORIDE ION, ...
著者Stetefeld, J, McDougall, M.D, Loewen, P.C.
登録日2018-12-13
公開日2018-12-26
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (3.15 Å)
主引用文献RHODOCETIN IN COMPLEX WITH THE INTEGRIN ALPHA2-A DOMAIN AND CADMIUM
To be published
3TCK
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BU of 3tck by Molmil
Crystal structure of Peptidyl-tRNA hydrolase from Mycobacterium tuberculosis - Form 4
分子名称: Peptidyl-tRNA hydrolase
著者Selvaraj, M, Ahmad, R, Varshney, U, Vijayan, M.
登録日2011-08-09
公開日2012-02-15
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Structures of new crystal forms of Mycobacterium tuberculosis peptidyl-tRNA hydrolase and functionally important plasticity of the molecule
Acta Crystallogr.,Sect.F, 68, 2012
3SU9
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BU of 3su9 by Molmil
E. Cloacae MURA in complex with UDP-N-acetylmuramic acid and covalent adduct of PEP with Cys115
分子名称: (2R)-2-{[(2R,3R,4R,5S,6R)-3-(acetylamino)-2-{[(S)-{[(R)-{[(2R,3S,4R,5R)-5-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methoxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]oxy}-5-hydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-4-yl]oxy}propanoic acid, 1,2-ETHANEDIOL, ACETATE ION, ...
著者Zhu, J.-Y, Yang, Y, Schonbrunn, E.
登録日2011-07-11
公開日2012-03-07
最終更新日2023-12-06
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Functional Consequence of Covalent Reaction of Phosphoenolpyruvate with UDP-N-acetylglucosamine 1-Carboxyvinyltransferase (MurA).
J.Biol.Chem., 287, 2012
3MP4
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BU of 3mp4 by Molmil
Crystal structure of Human lyase R41M mutant
分子名称: Hydroxymethylglutaryl-CoA lyase
著者Fu, Z, Runquist, J.A, Montgomery, C, Miziorko, H.M, Kim, J.-J.P.
登録日2010-04-24
公開日2010-06-16
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Functional insights into human HMG-CoA lyase from structures of Acyl-CoA-containing ternary complexes.
J.Biol.Chem., 285, 2010
6NFT
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BU of 6nft by Molmil
Structure of USP5 zinc-finger ubiquitin binding domain co-crystallized with (4-oxoquinazolin-3(4H)-yl)acetic acid
分子名称: (4-oxoquinazolin-3(4H)-yl)acetic acid, 1,2-ETHANEDIOL, UNKNOWN ATOM OR ION, ...
著者Harding, R.J, Mann, M.K, Tempel, W, Bountra, C, Arrowmsmith, C.M, Edwards, A.M, Schapira, M, Structural Genomics Consortium (SGC)
登録日2018-12-20
公開日2019-01-02
最終更新日2021-06-09
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Discovery of Small Molecule Antagonists of the USP5 Zinc Finger Ubiquitin-Binding Domain.
J.Med.Chem., 62, 2019
6NFX
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BU of 6nfx by Molmil
MBTD1 MBT repeats
分子名称: GLYCEROL, MBT domain-containing protein 1,Enhancer of polycomb homolog 1, SODIUM ION, ...
著者Zhang, H, Tempel, W, Bountra, C, Arrowsmith, C.H, Edwards, A.M, Min, J, Structural Genomics Consortium (SGC)
登録日2018-12-21
公開日2019-01-30
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献Structural Basis for EPC1-Mediated Recruitment of MBTD1 into the NuA4/TIP60 Acetyltransferase Complex.
Cell Rep, 30, 2020

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