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8KB8
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Structure of the WDR91 WD40 domain complexed with Rab7
分子名称: GUANOSINE-5'-TRIPHOSPHATE, MAGNESIUM ION, Ras-related protein Rab-7a, ...
著者Li, J, Ma, X.L, Banerjee, S, Dong, Z.G.
登録日2023-08-04
公開日2024-08-07
最終更新日2024-10-30
実験手法X-RAY DIFFRACTION (2.49 Å)
主引用文献Insights into the distinct membrane targeting mechanisms of WDR91 family proteins.
Structure, 2024
6MRV
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BU of 6mrv by Molmil
Sialidase26 co-crystallized with DANA
分子名称: 2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID, Sialidase26
著者Zaramela, L.S, Martino, C, Alisson-Silva, F, Rees, S.D, Diaz, S.L, Chuzel, L, Ganatra, M.B, Taron, C.H, Zuniga, C, Chang, G, Varki, A, Zengler, K.
登録日2018-10-15
公開日2019-10-02
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Gut bacteria responding to dietary change encode sialidases that exhibit preference for red meat-associated carbohydrates.
Nat Microbiol, 4, 2019
8SBN
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BU of 8sbn by Molmil
Crystal Structure of Dephospho-CoA kinase from Klebsiella aerogenes (P21 Form 1)
分子名称: CHLORIDE ION, Dephospho-CoA kinase, GLYCEROL, ...
著者Seattle Structural Genomics Center for Infectious Disease (SSGCID)
登録日2023-04-03
公開日2023-04-12
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (1.15 Å)
主引用文献Crystal Structure of Dephospho-CoA kinase from Klebsiella aerogenes (P21 Form 1)
To be published
5H4I
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BU of 5h4i by Molmil
Unlinked NS2B-NS3 Protease from Zika Virus in complex with a compound fragment
分子名称: ACETATE ION, NS2B cofactor, NS3 protease, ...
著者Zhang, Z.Z, Li, Y.
登録日2016-10-31
公開日2016-12-14
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (2.004 Å)
主引用文献Crystal structure of unlinked NS2B-NS3 protease from Zika virus
Science, 354, 2016
8SBV
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BU of 8sbv by Molmil
Crystal Structure of 2,3-dihydro-2,3-dihydroxybenzoate dehydrogenase from Klebsiella aerogenes (ADP bound)
分子名称: 2,3-dihydroxybenzoate-2,3-dehydrogenase, ACETATE ION, ADENOSINE-5'-DIPHOSPHATE, ...
著者Seattle Structural Genomics Center for Infectious Disease (SSGCID)
登録日2023-04-04
公開日2023-04-12
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (1.55 Å)
主引用文献Crystal Structure of 2,3-dihydro-2,3-dihydroxybenzoate dehydrogenase from Klebsiella aerogenes (ADP bound)
To be published
7P32
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BU of 7p32 by Molmil
Crystal structure of human lysosomal acid-alpha-glucosidase, GAA, in complex with cyclosulfamidate 6
分子名称: 1,2-ETHANEDIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ...
著者Roig-Zamboni, V, Kok, K, Overkleeft, H, Artola, M, Sulzenbacher, G.
登録日2021-07-06
公開日2022-07-13
最終更新日2024-07-31
実験手法X-RAY DIFFRACTION (1.82 Å)
主引用文献1,6- epi-Cyclophellitol Cyclosulfamidate Is a Bona Fide Lysosomal alpha-Glucosidase Stabilizer for the Treatment of Pompe Disease.
J.Am.Chem.Soc., 144, 2022
5TPH
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BU of 5tph by Molmil
Crystal structure of a de novo designed protein homodimer with curved beta-sheet
分子名称: CHLORIDE ION, DI(HYDROXYETHYL)ETHER, de novo NTF2 homodimer
著者Basanta, B, Marcos, E, Oberdorfer, G, Chidyausiku, T.M, Sankaran, B, Baker, D.
登録日2016-10-20
公開日2017-01-25
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (2.47 Å)
主引用文献Principles for designing proteins with cavities formed by curved beta sheets.
Science, 355, 2017
5U60
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BU of 5u60 by Molmil
CcP gateless cavity
分子名称: (4E)-4-hydrazinylidene-1,4-dihydroquinoline, PROTOPORPHYRIN IX CONTAINING FE, Peroxidase
著者Fischer, M, Shoichet, B.K.
登録日2016-12-07
公開日2017-02-01
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Testing inhomogeneous solvation theory in structure-based ligand discovery.
Proc. Natl. Acad. Sci. U.S.A., 114, 2017
8KAO
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BU of 8kao by Molmil
Glutamate dehydrogenase-69O
分子名称: 2-oxopentanoic acid, Glutamate dehydrogenase, NICOTINAMIDE-ADENINE-DINUCLEOTIDE
著者Sakuraba, H, Ohshima, T.
登録日2023-08-03
公開日2024-08-07
実験手法X-RAY DIFFRACTION (2.55 Å)
主引用文献Structure of glutamate dehydrogenase-69O
To be published
8SBO
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BU of 8sbo by Molmil
Crystal Structure of Dephospho-CoA kinase from Klebsiella aerogenes (P21 Form 2)
分子名称: (4S)-2-METHYL-2,4-PENTANEDIOL, CHLORIDE ION, Dephospho-CoA kinase
著者Seattle Structural Genomics Center for Infectious Disease (SSGCID)
登録日2023-04-03
公開日2023-04-12
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (1.4 Å)
主引用文献Crystal Structure of Dephospho-CoA kinase from Klebsiella aerogenes (P21 Form 2)
To be published
5CKL
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BU of 5ckl by Molmil
Fic protein from Neisseria meningitidis (NmFic) mutant E156R in dimeric form
分子名称: Adenosine monophosphate-protein transferase NmFic, CHLORIDE ION, GLYCEROL
著者Stanger, F.V, Schirmer, T.
登録日2015-07-15
公開日2016-01-27
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (0.99 Å)
主引用文献Intrinsic regulation of FIC-domain AMP-transferases by oligomerization and automodification.
Proc.Natl.Acad.Sci.USA, 113, 2016
8SAC
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BU of 8sac by Molmil
Crystal Structure of Cystathionine beta lyase from Klebsiella aerogenes (P21212 form)
分子名称: Cystathionine beta-lyase, MAGNESIUM ION, PYRIDOXAL-5'-PHOSPHATE
著者Seattle Structural Genomics Center for Infectious Disease (SSGCID)
登録日2023-03-31
公開日2023-04-12
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Crystal Structure of Cystathionine beta lyase from Klebsiella aerogenes (P21212 form)
To be published
5U72
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BU of 5u72 by Molmil
Structure of human MR1-5OH-DCF in complex with human MAIT A-F7 TCR
分子名称: 5-hydroxydiclofenac, ACETATE ION, Beta-2-microglobulin, ...
著者Keller, A.N, Rossjohn, J.
登録日2016-12-10
公開日2017-02-08
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献T-cell receptor complex
NAT.IMMUNOL., 2017
5CKY
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BU of 5cky by Molmil
Crystal Structure of the MTERF1 R162A substitution bound to the termination sequence.
分子名称: 5' -D (*TP*AP*AP*GP*AP*TP*GP*GP*CP*AP*GP*AP*GP*CP*CP*CP*GP*GP*TP*AP*AP*T)-3', 5'-D(*AP*TP*TP*AP*CP*CP*GP*GP*GP*CP*TP*CP*TP*GP*CP*CP*AP*TP*CP*TP*TP*A)-3', Transcription termination factor 1, ...
著者Byrnes, J, Hauser, K, Norona, L, Mejia, E, Simmerling, C, Garcia-Diaz, M.
登録日2015-07-15
公開日2015-11-25
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (2.62 Å)
主引用文献Base Flipping by MTERF1 Can Accommodate Multiple Conformations and Occurs in a Stepwise Fashion.
J.Mol.Biol., 428, 2016
8KD8
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BU of 8kd8 by Molmil
N(5)-hydroxyornithine:cis-anhydromevalonyl coenzyme A-N(5)-transacylase sidF N-terminal domain
分子名称: N(5)-hydroxyornithine:cis-anhydromevalonyl coenzyme A-N(5)-transacylase sidF
著者Poonsiri, T, Demitri, N, Benini, S.
登録日2023-08-09
公開日2024-08-14
実験手法X-RAY DIFFRACTION (2.581 Å)
主引用文献N(5)-hydroxyornithine:cis-anhydromevalonyl coenzyme A-N(5)-transacylase sidF N-terminal domain
To Be Published
8V7R
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BU of 8v7r by Molmil
PanDDA analysis -- Crystal Structure of Zika virus NS3 Helicase in complex with Z56772132
分子名称: (5R)-5-[2-(4-methoxyphenyl)ethyl]-5-methylimidazolidine-2,4-dione, 1,2-ETHANEDIOL, DIMETHYL SULFOXIDE, ...
著者Godoy, A.S, Noske, G.D, Fairhead, M, Lithgo, R.M, Koekemoer, L, Aschenbrenner, J.C, Balcomb, B.H, Marples, P.G, Ni, X, Tomlinson, C.W.E, Wild, C, Mesquita, N.C.M.R, Oliva, G, Fearon, D, Walsh, M.A, von Delft, F.
登録日2023-12-04
公開日2023-12-20
実験手法X-RAY DIFFRACTION (1.41 Å)
主引用文献PanDDA analysis -- Crystal Structure of Zika virus NS3 Helicase in complex with Z56772132
To Be Published
8KDU
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BU of 8kdu by Molmil
Crystal structure of trypsin with its substrate
分子名称: (2~{R})-2-benzamido-5-carbamimidamido-pentanoic acid, ARGININE, CALCIUM ION, ...
著者Akbar, Z, Ahmad, M.S.
登録日2023-08-10
公開日2024-08-14
最終更新日2024-09-18
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Crystal structure of the Michaelis complex of trypsin with N-alpha-benzoyl-l-arginine ethyl ester
J Chin Chem Soc, n/a, 2024
7P33
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BU of 7p33 by Molmil
Epstein-Barr virus encoded Bcl-2 homolog BHRF-1 in complex with Bid BH3 peptide
分子名称: 1,2-ETHANEDIOL, Apoptosis regulator BHRF1, BH3-interacting domain death agonist p15, ...
著者Suraweera, C.D, Hinds, M.G, Kvansakul, M.
登録日2021-07-07
公開日2022-07-20
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2.78542733 Å)
主引用文献Crystal Structures of Epstein-Barr Virus Bcl-2 Homolog BHRF1 Bound to Bid and Puma BH3 Motif Peptides.
Viruses, 14, 2022
7Y0L
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BU of 7y0l by Molmil
SulE-S209A
分子名称: Alpha/beta fold hydrolase, GLYCEROL, METHYL 2-[({[(4-METHOXY-6-METHYL-1,3,5-TRIAZIN-2-YL)AMINO]CARBONYL}AMINO)SULFONYL]BENZOATE
著者Liu, B, Ran, T, He, J, Wang, W.
登録日2022-06-05
公開日2023-08-02
最終更新日2024-05-29
実験手法X-RAY DIFFRACTION (1.29 Å)
主引用文献Crystal structures of herbicide-detoxifying esterase reveal a lid loop affecting substrate binding and activity.
Nat Commun, 14, 2023
8SBW
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BU of 8sbw by Molmil
Crystal Structure of 2,3-dihydro-2,3-dihydroxybenzoate dehydrogenase from Klebsiella aerogenes (Apo, orthorhombic form)
分子名称: 2,3-dihydroxybenzoate-2,3-dehydrogenase, ACETATE ION, SULFATE ION
著者Seattle Structural Genomics Center for Infectious Disease (SSGCID)
登録日2023-04-04
公開日2023-04-12
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (1.75 Å)
主引用文献Crystal Structure of 2,3-dihydro-2,3-dihydroxybenzoate dehydrogenase from Klebsiella aerogenes (Apo, orthorhombic form)
To be published
7P2W
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BU of 7p2w by Molmil
E.coli GyrB24 with inhibitor LMD92 (EBL2682)
分子名称: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 2-[[3,4-bis(chloranyl)-5-methyl-1H-pyrrol-2-yl]carbonylamino]-4-[(3-carboxyphenyl)methoxy]-1,3-benzothiazole-6-carboxylic acid, DNA gyrase subunit B, ...
著者Stevenson, C.E.M, Lawson, D.M, Maxwell, A.M, Henderson, S.R, Kikelj, D, Durcik, M, Zega, A, Zidar, N, Ilas, J, Tomasic, T, Masic, L.P.
登録日2021-07-06
公開日2022-07-20
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Discovery and Hit-to-Lead Optimization of Benzothiazole Scaffold-Based DNA Gyrase Inhibitors with Potent Activity against Acinetobacter baumannii and Pseudomonas aeruginosa.
J.Med.Chem., 66, 2023
8KC4
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BU of 8kc4 by Molmil
De novo design protein -NA05
分子名称: De novo design protein -NA05
著者Wang, S, Liu, Y.
登録日2023-08-06
公開日2024-08-07
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献De novo design protein -NA05
To Be Published
5C0M
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BU of 5c0m by Molmil
Crystal structure of SGF29 tandem tudor domain in complex with a Carba containing peptide
分子名称: Carba-containing peptide, GLYCEROL, SAGA-associated factor 29 homolog, ...
著者Dong, A, Xu, C, Tempel, W, Cerovina, T, Bountra, C, Arrowsmith, C.H, Edwards, A.M, Min, J, Structural Genomics Consortium (SGC)
登録日2015-06-12
公開日2015-07-01
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Chemical basis for the recognition of trimethyllysine by epigenetic reader proteins.
Nat Commun, 6, 2015
8JY1
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BU of 8jy1 by Molmil
Structure of Mangifera Indica Epoxide hydrolase 2
分子名称: Epoxide hydrolase-2, TETRAETHYLENE GLYCOL
著者Bhoite, A.S, Gupta, V.S, Kulkarni, K.A.
登録日2023-07-02
公開日2024-08-07
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Structure of Mangifera Indica Epoxide hydrolase 2
To Be Published
7P2X
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BU of 7p2x by Molmil
E.coli GyrB24 with inhibitor KOB20 (EBL2583)
分子名称: (2Z)-2-[[4,5-bis(bromanyl)-1H-pyrrol-2-yl]carbonylimino]-3-(phenylmethyl)-1,3-benzothiazole-6-carboxylic acid, DNA gyrase subunit B, PHOSPHATE ION
著者Stevenson, C.E.M, Lawson, D.M, Maxwell, A.M, Henderson, S.R, Kikelj, D, Benek, O, Zega, A, Zidar, N, Ilas, J, Tomasic, T, Masic, L.P.
登録日2021-07-06
公開日2022-07-20
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献E.coli GyrB24 with inhibitor KOB20 (EBL2583)
TO BE PUBLISHED

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件を2024-10-30に公開中

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