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7XWU
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BU of 7xwu by Molmil
Ketoreductase CpKR mutant - M1
Descriptor: DI(HYDROXYETHYL)ETHER, Epimerase domain-containing protein, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
Authors:Chen, C, Zheng, Y.C, Pan, J, Xu, J.H.
Deposit date:2022-05-27
Release date:2023-05-31
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2 Å)
Cite:Computational Redesign of a robust Ketoreductase for Asymmetric Synthesis of Enantiopure diltiazem precursor.
To Be Published
7Y0K
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BU of 7y0k by Molmil
Crystal structure of CpKR in complex with NADPH complex from Candida parapsilosis
Descriptor: Epimerase domain-containing protein, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
Authors:Chen, C, Pan, J, Xu, J.H.
Deposit date:2022-06-05
Release date:2023-06-14
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (3.03 Å)
Cite:Computational Redesign of a robust Ketoreductase for Asymmetric Synthesis of Enantiopure diltiazem precursor.
To Be Published
7XDU
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BU of 7xdu by Molmil
TtherAmDH-NAD+
Descriptor: 4-hydroxy-tetrahydrodipicolinate reductase, NICOTINAMIDE-ADENINE-DINUCLEOTIDE
Authors:Chen, C, Qian, Y.Y, Pan, J, Bai, Y.P, Xu, J.H.
Deposit date:2022-03-28
Release date:2023-04-05
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Stereoselective synthesis of chiral lactams via an engineered natural amine dehydrogenase.
To Be Published
7CG2
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BU of 7cg2 by Molmil
Vigna radiata Epoxide hydrolase mutant
Descriptor: Epoxide hydrolase
Authors:Li, F.L, Yu, H.L, Xu, J.H.
Deposit date:2020-06-30
Release date:2021-07-07
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.001 Å)
Cite:Reprogramming Epoxide Hydrolase to Improve Enantioconvergence in Hydrolysis of Styrene Oxide Scaffolds
Adv.Synth.Catal., 362, 2021
7CG6
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BU of 7cg6 by Molmil
Vigna radiata Epoxide hydrolase mutant M263Q
Descriptor: Epoxide hydrolase
Authors:Li, F.L, Yu, H.L, Xu, J.H.
Deposit date:2020-06-30
Release date:2021-07-07
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2 Å)
Cite:Reprogramming Epoxide Hydrolase to Improve Enantioconvergence in Hydrolysis of Styrene Oxide Scaffolds
Adv.Synth.Catal., 362, 2021
7DUS
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BU of 7dus by Molmil
Crystal structure of Mei2-RRM3 domain in S.pombe
Descriptor: CITRIC ACID, Meiosis protein mei2
Authors:Wu, B.X, Xu, J.H, Ma, J.B.
Deposit date:2021-01-11
Release date:2021-07-07
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Crystal structure of Mei2-RRM3 domain in S.pombe
To Be Published
7BWP
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BU of 7bwp by Molmil
Crystal complex of endo-deglycosylated PcHNL5 with (R)-mandelonitrile
Descriptor: (2R)-hydroxy(phenyl)ethanenitrile, 2-acetamido-2-deoxy-beta-D-glucopyranose, DI(HYDROXYETHYL)ETHER, ...
Authors:Zheng, Y.C, Li, F.L, Yu, H.L, Xu, J.H.
Deposit date:2020-04-15
Release date:2020-05-13
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.802 Å)
Cite:Structure-Guided Tuning of a Hydroxynitrile Lyase to Accept Rigid Pharmaco Aldehydes.
Acs Catalysis, 2020
7FEC
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BU of 7fec by Molmil
Cryo-EM structure of the nonameric SsaV cytosolic domain with C9 symmetry
Descriptor: Secretion system apparatus protein SsaV
Authors:Xu, J.H, Zhang, Y.Q, Gao, X.
Deposit date:2021-07-19
Release date:2022-02-16
Last modified:2024-06-12
Method:ELECTRON MICROSCOPY (3.64 Å)
Cite:Structural and Functional Analysis of SsaV Cytoplasmic Domain and Variable Linker States in the Context of the InvA-SsaV Chimeric Protein.
Microbiol Spectr, 9, 2021
7FEB
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BU of 7feb by Molmil
Cryo-EM structure of the nonameric SsaV cytosolic domain in the context of the InvA-SsaV chimeric protein
Descriptor: Secretion system apparatus protein SsaV
Authors:Xu, J.H, Zhang, Y.Q, Gao, X.
Deposit date:2021-07-19
Release date:2022-02-16
Last modified:2024-06-12
Method:ELECTRON MICROSCOPY (2.11 Å)
Cite:Structural and Functional Analysis of SsaV Cytoplasmic Domain and Variable Linker States in the Context of the InvA-SsaV Chimeric Protein.
Microbiol Spectr, 9, 2021
7FED
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BU of 7fed by Molmil
Cryo-EM structure of the nonameric SsaV cytosolic domain with D9 symmetry
Descriptor: Secretion system apparatus protein SsaV
Authors:Xu, J.H, Zhang, Y.Q, Gao, X.
Deposit date:2021-07-19
Release date:2022-02-16
Last modified:2024-06-12
Method:ELECTRON MICROSCOPY (3.55 Å)
Cite:Structural and Functional Analysis of SsaV Cytoplasmic Domain and Variable Linker States in the Context of the InvA-SsaV Chimeric Protein.
Microbiol Spectr, 9, 2021
8HM3
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BU of 8hm3 by Molmil
Complex of PPIase-BfUbb
Descriptor: GLYCEROL, MAGNESIUM ION, Peptidylprolyl isomerase, ...
Authors:Xu, J.H, Chen, Z, Gao, X.
Deposit date:2022-12-02
Release date:2023-11-29
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (2.26 Å)
Cite:Bacteroides fragilis ubiquitin homologue drives intraspecies bacterial competition in the gut microbiome.
Nat Microbiol, 9, 2024
8HM4
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BU of 8hm4 by Molmil
Crystal structure of PPIase
Descriptor: Peptidylprolyl isomerase
Authors:Xu, J.H, Chen, Z, Gao, X.
Deposit date:2022-12-02
Release date:2023-11-29
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (3.79 Å)
Cite:Bacteroides fragilis ubiquitin homologue drives intraspecies bacterial competition in the gut microbiome.
Nat Microbiol, 9, 2024
5JJO
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BU of 5jjo by Molmil
The crystal structure of immunity protein PA5088 from Pseudomonas aeruginosa
Descriptor: GOLD ION, Uncharacterized protein
Authors:Li, Z.Q, Gao, Z.Q, She, Z, Dong, Y.H.
Deposit date:2016-04-24
Release date:2016-08-31
Method:X-RAY DIFFRACTION (2.002 Å)
Cite:Structural analysis of Pseudomonas aeruginosa H3-T6SS immunity proteins
Febs Lett., 590, 2016
4HFL
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BU of 4hfl by Molmil
Crystal structure of the type VI effector Tae4 from Enterobacter cloacae
Descriptor: Putative cytoplasmic protein
Authors:Zhang, H, Gao, Z.Q, Dong, Y.H.
Deposit date:2012-10-05
Release date:2013-01-16
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2.002 Å)
Cite:Structure of the type VI effector-immunity complex (Tae4-Tai4) provides novel insights into the inhibition mechanism of the effector by its immunity protein.
J.Biol.Chem., 288, 2013
4HFF
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BU of 4hff by Molmil
Crystal structure of the type VI effector-immunity complex Tae4-Tai4 from Salmonella Typhimurium
Descriptor: Putative cytoplasmic protein, Putative periplasmic protein
Authors:Zhang, H, Gao, Z.Q, Dong, Y.H.
Deposit date:2012-10-05
Release date:2013-01-16
Last modified:2013-07-24
Method:X-RAY DIFFRACTION (2.398 Å)
Cite:Structure of the type VI effector-immunity complex (Tae4-Tai4) provides novel insights into the inhibition mechanism of the effector by its immunity protein
J.Biol.Chem., 288, 2013
5YQT
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BU of 5yqt by Molmil
Crystal Structure of the L74F/M78V/I80V/L114F mutant of LEH complexed with cyclopentene oxide
Descriptor: (1R,5S)-6-oxabicyclo[3.1.0]hexane, Limonene-1,2-epoxide hydrolase
Authors:Kong, X.D, Sun, Z.T, Wu, L, Reetz, M.T, Zhou, J.H, Xu, J.H.
Deposit date:2017-11-07
Release date:2018-06-27
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Structural and Computational Insight into the Catalytic Mechanism of Limonene Epoxide Hydrolase Mutants in Stereoselective Transformations.
J. Am. Chem. Soc., 140, 2018
5JKP
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BU of 5jkp by Molmil
Crystal structure of immunity protein Pa5087 from Pseudomonas aeruginosa
Descriptor: Uncharacterized protein
Authors:Li, Z.Q, Gao, Z.Q, She, Z, Dong, Y.H.
Deposit date:2016-04-26
Release date:2016-08-31
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2.106 Å)
Cite:Structural analysis of Pseudomonas aeruginosa H3-T6SS immunity proteins
Febs Lett., 590, 2016
4XGA
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BU of 4xga by Molmil
Crystal structure of BamB and BamA P3-5 complex from E.coli
Descriptor: CALCIUM ION, Outer membrane protein assembly factor BamA, Outer membrane protein assembly factor BamB
Authors:Chen, Z, Zhan, L.H, Dong, C, Gao, Z.Q, Dong, Y.H.
Deposit date:2014-12-30
Release date:2016-01-20
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2.15 Å)
Cite:Structural basis for the interaction of BamB with the POTRA3-4 domains of BamA.
Acta Crystallogr D Struct Biol, 72, 2016
4JUR
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BU of 4jur by Molmil
Crystal structure of the effector Tae4 from Salmonella typhimurium in complex with the immunity Tai4 from Enterobacter cloacae
Descriptor: Putative cytoplasmic protein, Uncharacterized protein
Authors:Zhang, H, Gao, Z.Q, Dong, Y.H.
Deposit date:2013-03-25
Release date:2014-02-05
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Insights into the cross-immunity mechanism within effector families of bacteria type VI secretion system from the structure of StTae4-EcTai4 complex
Plos One, 8, 2013
6LR8
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BU of 6lr8 by Molmil
Mutant L331A of deglycosylated hydroxynitrile lyase isozyme 5 from Prunus communis
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, FLAVIN-ADENINE DINUCLEOTIDE, ...
Authors:Zheng, Y.-C, Xu, J.-H.
Deposit date:2020-01-15
Release date:2020-05-13
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.595 Å)
Cite:Structure-Guided Tuning of a Hydroxynitrile Lyase to Accept Rigid Pharmaco Aldehydes.
Acs Catalysis, 2020
8J3O
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BU of 8j3o by Molmil
Formate dehydrogenase wild-type enzyme from Candida dubliniensis complexed with NADH
Descriptor: 1,4-DIHYDRONICOTINAMIDE ADENINE DINUCLEOTIDE, Formate dehydrogenase, MAGNESIUM ION
Authors:Ma, W, Zheng, Y.C, Geng, Q, Chen, C.
Deposit date:2023-04-17
Release date:2023-09-20
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (2.65 Å)
Cite:Engineering a Formate Dehydrogenase for NADPH Regeneration.
Chembiochem, 24, 2023
2HCU
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BU of 2hcu by Molmil
Crystal Structure Of Smu.1381 (or LeuD) from Streptococcus Mutans
Descriptor: 3-isopropylmalate dehydratase small subunit, SULFATE ION
Authors:Gao, Z.Q, Hou, H.F, Li, L.F, Liang, Y.H, Su, X.D, Dong, Y.H.
Deposit date:2006-06-19
Release date:2006-07-04
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Crystal Structure Of Smu.1381 (or LeuD) from Streptococcus Mutans
To be Published
3DEZ
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BU of 3dez by Molmil
Crystal structure of Orotate phosphoribosyltransferase from Streptococcus mutans
Descriptor: Orotate phosphoribosyltransferase, SULFATE ION
Authors:Liu, C.P, Gao, Z.Q, Hou, H.F, Li, L.F, Su, X.D, Dong, Y.H.
Deposit date:2008-06-11
Release date:2009-06-16
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Structure of orotate phosphoribosyltransferase from the caries pathogen Streptococcus mutans
Acta Crystallogr.,Sect.F, 66, 2010
6JDP
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BU of 6jdp by Molmil
the imm52 family protein TsiT (PA3908) from Pseudomonas aeruginosa
Descriptor: Imm52 family protein, PHOSPHATE ION, SODIUM ION
Authors:She, Z.
Deposit date:2019-02-02
Release date:2019-03-20
Last modified:2024-03-27
Method:X-RAY DIFFRACTION (1.601 Å)
Cite:Structural characterization of the Imm52 family protein TsiT in Pseudomonas aeruginosa.
Protein Sci., 28, 2019
3TKA
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BU of 3tka by Molmil
crystal structure and solution saxs of methyltransferase rsmh from E.coli
Descriptor: 4-AMINO-1-BETA-D-RIBOFURANOSYL-2(1H)-PYRIMIDINONE, Ribosomal RNA small subunit methyltransferase H, S-ADENOSYLMETHIONINE, ...
Authors:Gao, Z.Q, Wei, Y, Zhang, H, Dong, Y.H.
Deposit date:2011-08-25
Release date:2012-05-30
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (2.25 Å)
Cite:Crystal and solution structures of methyltransferase RsmH provide basis for methylation of C1402 in 16S rRNA.
J.Struct.Biol., 179, 2012

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数据于2024-06-19公开中

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