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3SW2
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BU of 3sw2 by Molmil
X-ray crystal structure of human FXA in complex with 6-chloro-N-((3S)-2-oxo-1-(2-oxo-2-((5S)-8-oxo-5,6-dihydro-1H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(2H,4H,8H)-yl)ethyl)piperidin-3-yl)naphthalene-2-sulfonamide
Descriptor: 6-chloro-N-((3S)-2-oxo-1-(2-oxo-2-((5S)-8-oxo-5,6-dihydro-1H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(2H,4H,8H)-yl)ethyl)piperidin-3-yl)naphthalene-2-sulfonamide, CALCIUM ION, Coagulation factor X, ...
Authors:Klei, H.E.
Deposit date:2011-07-13
Release date:2011-11-16
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2.42 Å)
Cite:Arylsulfonamidopiperidone derivatives as a novel class of factor Xa inhibitors.
Bioorg.Med.Chem.Lett., 21, 2011
7Y76
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BU of 7y76 by Molmil
SIT1-ACE2-BA.5 RBD
Descriptor: 1,2-DIACYL-GLYCEROL-3-SN-PHOSPHATE, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:Shen, Y.P, Li, Y.N, Zhang, Y.Y, Yan, R.H.
Deposit date:2022-06-21
Release date:2023-01-04
Last modified:2023-02-08
Method:ELECTRON MICROSCOPY (3.2 Å)
Cite:Structures of ACE2-SIT1 recognized by Omicron variants of SARS-CoV-2.
Cell Discov, 8, 2022
5IR6
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BU of 5ir6 by Molmil
The structure of bd oxidase from Geobacillus thermodenitrificans
Descriptor: Bd-type quinol oxidase subunit I, Bd-type quinol oxidase subunit II, CIS-HEME D HYDROXYCHLORIN GAMMA-SPIROLACTONE, ...
Authors:Safarian, S, Mueller, H, Rajendran, C, Preu, J, Ovchinnikov, S, Kusumoto, T, Hirose, T, Langer, J, Sakamoto, J, Michel, H.
Deposit date:2016-03-12
Release date:2016-05-04
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (3.8 Å)
Cite:Structure of a bd oxidase indicates similar mechanisms for membrane-integrated oxygen reductases.
Science, 352, 2016
6ZYW
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BU of 6zyw by Molmil
Outer Dynein Arm-Shulin complex - overall structure (Tetrahymena thermophila)
Descriptor: ADENOSINE-5'-DIPHOSPHATE, ADENOSINE-5'-TRIPHOSPHATE, Dynein heavy chain, ...
Authors:Mali, G.R, Abid Ali, F, Lau, C.K, Carter, A.P.
Deposit date:2020-08-03
Release date:2021-01-20
Last modified:2024-05-01
Method:ELECTRON MICROSCOPY (8.78 Å)
Cite:Shulin packages axonemal outer dynein arms for ciliary targeting.
Science, 371, 2021
6UJ1
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BU of 6uj1 by Molmil
BACE2 mutant in complex with a macrocyclic compound
Descriptor: (3S)-3-hydroxy-N-(2-methylpropyl)-N~2~-{[(4S)-17-[(methylsulfonyl)(propyl)amino]-2-oxo-3-azatricyclo[13.3.1.1~6,10~]icosa-1(19),6(20),7,9,15,17-hexaen-4-yl]methyl}-L-norleucinamide, Beta-secretase 2
Authors:Yen, Y.C, Ghosh, A.K, Mesecar, A.D.
Deposit date:2019-10-02
Release date:2020-10-07
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (3.03 Å)
Cite:A Structure-Based Discovery Platform for BACE2 and the Development of Selective BACE Inhibitors.
Acs Chem Neurosci, 12, 2021
5NF8
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BU of 5nf8 by Molmil
Solution structure of detergent-solubilized Rcf1, a yeast mitochondrial inner membrane protein involved in respiratory Complex III/IV supercomplex formation
Descriptor: Respiratory supercomplex factor 1, mitochondrial
Authors:Zhou, S, Pettersson, P, Sjoholm, J, Sjostrand, D, Hogbom, M, Brzezinski, P, Maler, L, Adelroth, P.
Deposit date:2017-03-13
Release date:2018-02-28
Last modified:2024-06-19
Method:SOLUTION NMR
Cite:Solution NMR structure of yeast Rcf1, a protein involved in respiratory supercomplex formation.
Proc. Natl. Acad. Sci. U.S.A., 115, 2018
6UGM
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BU of 6ugm by Molmil
Structural basis of COMPASS eCM recognition of an unmodified nucleosome
Descriptor: Bre2, DNA (146-MER), H3 N-terminus, ...
Authors:Hsu, P.L, Shi, H, Zheng, N.
Deposit date:2019-09-26
Release date:2019-11-20
Last modified:2024-03-20
Method:ELECTRON MICROSCOPY (3.7 Å)
Cite:Structural Basis of H2B Ubiquitination-Dependent H3K4 Methylation by COMPASS.
Mol.Cell, 76, 2019
4KB5
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BU of 4kb5 by Molmil
Crystal structure of MycP1 from Mycobacterium smegmatis
Descriptor: GLYCEROL, Membrane-anchored mycosin mycp1
Authors:Sun, D.M, He, Y, Tian, C.L.
Deposit date:2013-04-23
Release date:2014-02-05
Method:X-RAY DIFFRACTION (2.15 Å)
Cite:The putative propeptide of MycP1 in mycobacterial type VII secretion system does not inhibit protease activity but improves protein stability.
Protein Cell, 4, 2013
7YEZ
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BU of 7yez by Molmil
In situ structure of polymerase complex of mammalian reovirus in the reloaded state
Descriptor: Lambda-2 protein, Mu-2 protein, RNA helicase, ...
Authors:Bao, K.Y, Zhang, X.L, Li, D.Y, Zhu, P.
Deposit date:2022-07-06
Release date:2023-03-29
Last modified:2024-07-03
Method:ELECTRON MICROSCOPY (3.4 Å)
Cite:In situ structures of polymerase complex of mammalian reovirus illuminate RdRp activation and transcription regulation.
Proc.Natl.Acad.Sci.USA, 119, 2022
7YF0
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BU of 7yf0 by Molmil
In situ structure of polymerase complex of mammalian reovirus in the core
Descriptor: Lambda-2 protein, Mu-2 protein, RNA helicase, ...
Authors:Bao, K.Y, Zhang, X.L, Li, D.Y, Zhu, P.
Deposit date:2022-07-07
Release date:2023-03-29
Method:ELECTRON MICROSCOPY (3.4 Å)
Cite:In situ structures of polymerase complex of mammalian reovirus illuminate RdRp activation and transcription regulation.
Proc.Natl.Acad.Sci.USA, 119, 2022
7YFE
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BU of 7yfe by Molmil
In situ structure of polymerase complex of mammalian reovirus in virion
Descriptor: Lambda-2 protein, Mu-2 protein, RNA (5'-R(P*AP*CP*GP*AP*UP*UP*AP*GP*C)-3'), ...
Authors:Bao, K.Y, Zhang, X.L, Li, D.Y, Zhu, P.
Deposit date:2022-07-08
Release date:2023-03-29
Method:ELECTRON MICROSCOPY (3.4 Å)
Cite:In situ structures of polymerase complex of mammalian reovirus illuminate RdRp activation and transcription regulation.
Proc.Natl.Acad.Sci.USA, 119, 2022
7YEV
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BU of 7yev by Molmil
In situ structure of polymerase complex of mammalian reovirus in the pre-elongation state
Descriptor: Lambda-2 protein, Mu-2 protein, RNA helicase, ...
Authors:Bao, K.Y, Zhang, X.L, Li, D.Y, Zhu, P.
Deposit date:2022-07-06
Release date:2023-03-29
Method:ELECTRON MICROSCOPY (3.6 Å)
Cite:In situ structures of polymerase complex of mammalian reovirus illuminate RdRp activation and transcription regulation.
Proc.Natl.Acad.Sci.USA, 119, 2022
7YED
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BU of 7yed by Molmil
In situ structure of polymerase complex of mammalian reovirus in the elongation state
Descriptor: GUANOSINE-5'-TRIPHOSPHATE, Lambda-2 protein, MAGNESIUM ION, ...
Authors:Bao, K.Y, Zhang, X.L, Li, D.Y, Zhu, P.
Deposit date:2022-07-05
Release date:2023-04-05
Last modified:2024-07-03
Method:ELECTRON MICROSCOPY (3 Å)
Cite:In situ structures of polymerase complex of mammalian reovirus illuminate RdRp activation and transcription regulation.
Proc.Natl.Acad.Sci.USA, 119, 2022
7YF3
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BU of 7yf3 by Molmil
Crystal structure of METTL9 in complex with unmethylated S100A9 peptide and SAH
Descriptor: Protein-L-histidine N-pros-methyltransferase, S-ADENOSYL-L-HOMOCYSTEINE, S100A9 peptide
Authors:Xie, H, Wang, X, Xu, C.
Deposit date:2022-07-07
Release date:2023-04-12
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (3.434 Å)
Cite:Molecular basis for METTL9-mediated N1-histidine methylation.
Cell Discov, 9, 2023
7Y9C
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BU of 7y9c by Molmil
Crystal structure of METTL9 in complex with SLC39A5 peptide and SAH
Descriptor: Protein-L-histidine N-pros-methyltransferase, S-ADENOSYL-L-HOMOCYSTEINE, SLC39A5
Authors:Xie, H, Wang, X, Xu, C.
Deposit date:2022-06-24
Release date:2023-04-12
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Molecular basis for METTL9-mediated N1-histidine methylation.
Cell Discov, 9, 2023
7YF4
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BU of 7yf4 by Molmil
Crystal structure of METTL9 in complex with SLC39A5 mutant peptide and SAH
Descriptor: Protein-L-histidine N-pros-methyltransferase, S-ADENOSYL-L-HOMOCYSTEINE, SLC39A5 mutant peptide
Authors:Xie, H, Wang, X, Xu, C.
Deposit date:2022-07-07
Release date:2023-04-12
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (2.75 Å)
Cite:Molecular basis for METTL9-mediated N1-histidine methylation.
Cell Discov, 9, 2023
7YF2
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BU of 7yf2 by Molmil
Crystal structure of METTL9 in complex with unmethylated SLC39A5 peptide and SAH
Descriptor: Protein-L-histidine N-pros-methyltransferase, S-ADENOSYL-L-HOMOCYSTEINE, SLC39A5 peptide
Authors:Xie, H, Wang, X, Xu, C.
Deposit date:2022-07-07
Release date:2023-04-12
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (1.691 Å)
Cite:Molecular basis for METTL9-mediated N1-histidine methylation.
Cell Discov, 9, 2023
4TLR
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BU of 4tlr by Molmil
NS5b in complex with lactam-thiophene carboxylic acids
Descriptor: 3-{(2R,5R)-5-cyclohexyl-2-[(2R)-2-hydroxypropyl]-3-oxomorpholin-4-yl}-5-(3,3-dimethylbut-1-yn-1-yl)thiophene-2-carboxylic acid, 5-cyclopropyl-2-(4-fluorophenyl)-6-[(2-hydroxyethyl)(methylsulfonyl)amino]-N-methyl-1-benzofuran-3-carboxamide, NS5b
Authors:Chopra, R.
Deposit date:2014-05-30
Release date:2014-12-10
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (1.86 Å)
Cite:Design and synthesis of lactam-thiophene carboxylic acids as potent hepatitis C virus polymerase inhibitors.
Bioorg.Med.Chem.Lett., 24, 2014
4RV3
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BU of 4rv3 by Molmil
Crystal structure of a pentafluoro-Phe incorporated Phosphatidylinositol-specific phospholipase C (H258X)from Staphylococcus aureus
Descriptor: 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE, 1-phosphatidylinositol phosphodiesterase, ACETATE ION
Authors:He, T, Gershenson, A, Eyles, S.J, Gao, J, Roberts, M.F.
Deposit date:2014-11-24
Release date:2015-07-01
Last modified:2018-08-29
Method:X-RAY DIFFRACTION (2 Å)
Cite:Fluorinated Aromatic Amino Acids Distinguish Cation-pi Interactions from Membrane Insertion.
J.Biol.Chem., 290, 2015
7BXZ
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BU of 7bxz by Molmil
Crystal structure of the aminoglycoside 6'-N-acetyltransferase from Enterococcus faecium
Descriptor: Aminoglycoside 6'-N-acetyltransferase
Authors:Kwon, S, Park, H.H.
Deposit date:2020-04-21
Release date:2020-08-12
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.502 Å)
Cite:Structural analysis of a novel substrate-free form of the aminoglycoside 6'-N-acetyltransferase from Enterococcus faecium.
Acta Crystallogr.,Sect.F, 76, 2020
5L9Y
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BU of 5l9y by Molmil
Crystal structure of human heparanase, in complex with glucuronic acid configured aziridine probe JJB355
Descriptor: (1~{S},2~{R},3~{S},4~{S},5~{S},6~{R})-2-(8-azidooctylamino)-3,4,5,6-tetrakis(oxidanyl)cyclohexane-1-carboxylic acid, 1,2-ETHANEDIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:Wu, L, Jin, Y, Davies, G.J.
Deposit date:2016-06-13
Release date:2017-05-31
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.88 Å)
Cite:Activity-based probes for functional interrogation of retaining beta-glucuronidases.
Nat. Chem. Biol., 13, 2017
7X51
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BU of 7x51 by Molmil
Crystal structure of Bacteroides thetaiotaomicron glutamate decarboxylase BTGAD-PLP-GUA complex
Descriptor: GLUTARIC ACID, Glutamate decarboxylase, MALONATE ION, ...
Authors:Liu, S, Du, G, Wang, L, Wen, B, Xin, F.
Deposit date:2022-03-03
Release date:2023-04-19
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2 Å)
Cite:Coordinated regulation of Bacteroides thetaiotaomicron glutamate decarboxylase activity by multiple elements under different pH.
Food Chem, 403, 2023
6JCM
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BU of 6jcm by Molmil
Crystal structure of ligand-free Rv0187.
Descriptor: ACETATE ION, Probable O-methyltransferase
Authors:Kim, J, Lee, S.
Deposit date:2019-01-29
Release date:2019-12-11
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.08 Å)
Cite:Structural and biochemical characterization of Rv0187, an O-methyltransferase from Mycobacterium tuberculosis.
Sci Rep, 9, 2019
7FFT
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BU of 7fft by Molmil
The crystal structure of a domain-swapped dimeric maltodextrin-binding protein MalE from Salmonella enterica
Descriptor: Maltodextrin-binding protein, alpha-D-glucopyranose-(1-4)-alpha-D-glucopyranose-(1-4)-alpha-D-glucopyranose-(1-4)-alpha-D-glucopyranose-(1-4)-alpha-D-glucopyranose
Authors:Wang, L, Bu, T, Bai, X.
Deposit date:2021-07-23
Release date:2021-09-15
Last modified:2024-05-29
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Crystal structure of the domain-swapped dimeric maltodextrin-binding protein MalE from Salmonella enterica.
Acta Crystallogr D Struct Biol, 78, 2022
7FFW
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BU of 7ffw by Molmil
The crystal structure of a domain-swapped dimeric maltodextrin-binding protein MalE from Salmonella enterica
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, GLYCEROL, METHOXYETHANE, ...
Authors:Wang, L, Bu, T, Bai, X.
Deposit date:2021-07-23
Release date:2021-09-15
Last modified:2024-05-29
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Crystal structure of the domain-swapped dimeric maltodextrin-binding protein MalE from Salmonella enterica.
Acta Crystallogr D Struct Biol, 78, 2022

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數據於2024-09-11公開中

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