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5YC7
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BU of 5yc7 by Molmil
The crystal structure of uPA in complex with 4-Bromobenzylamirne at pH7.4
Descriptor: 1-(4-BROMOPHENYL)METHANAMINE, SULFATE ION, Urokinase-type plasminogen activator
Authors:Jiang, L.G, Zhang, X, Huang, M.D.
Deposit date:2017-09-06
Release date:2018-10-03
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (2 Å)
Cite:Halogen bonding for the design of inhibitors by targeting the S1 pocket of serine proteases
Rsc Adv, 8, 2018
6KY5
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BU of 6ky5 by Molmil
Crystal structure of a hydrolase mutant
Descriptor: PET hydrolase, SULFATE ION
Authors:Cui, Y.L, Chen, Y.C, Liu, X.Y, Dong, S.J, Han, J, Xiang, H, Chen, Q, Liu, H.Y, Han, X, Liu, W.D, Tang, S.Y, Wu, B.
Deposit date:2019-09-16
Release date:2020-09-23
Last modified:2024-11-13
Method:X-RAY DIFFRACTION (1.631 Å)
Cite:Computational redesign of PETase for plasticbiodegradation by GRAPE strategy.
Biorxiv, 2020
9JE9
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BU of 9je9 by Molmil
Crystal structure of a amidase that can hydrolase PU plastic
Descriptor: Amidase
Authors:Li, Z.S, Fang, S.T, Zheng, Z.R, Xia, W, Zhou, H.Y, Li, W.S, You, S, Han, X, Liu, W.D.
Deposit date:2024-09-02
Release date:2025-07-09
Method:X-RAY DIFFRACTION (2.41 Å)
Cite:Discovery and Engineering of a Urethanase for Enhanced Depolymerization of Polyurethane
Acs Catalysis, 15, 2025
8XTC
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BU of 8xtc by Molmil
Crystal structure of a novel PU plastic degradation urethanase UMG-SP2 mutant from uncultured bacterium in complex with ligand
Descriptor: 4-oxidanylbutyl ~{N}-(4-aminophenyl)carbamate, GLYCEROL, umgsp2-mut
Authors:Cong, L, Li, Z.S, Zheng, Z.R, Han, X, Gert, W, Wei, R, Liu, W.D, Bornscheuer, U.T.
Deposit date:2024-01-10
Release date:2025-01-15
Last modified:2025-04-30
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Structure-Guided Engineering of a Versatile Urethanase Improves Its Polyurethane Depolymerization Activity.
Adv Sci, 12, 2025
8XTB
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BU of 8xtb by Molmil
Crystal structure of a novel PU plastic degradation urethanase UMG-SP2 from uncultured bacterium in complex with ligand
Descriptor: 4-oxidanylbutyl ~{N}-(4-aminophenyl)carbamate, umgsp2
Authors:Cong, L, Li, Z.S, Zheng, Z.R, Han, X, Wei, R, Liu, W.D, Uwe, B.
Deposit date:2024-01-10
Release date:2025-01-15
Last modified:2025-02-19
Method:X-RAY DIFFRACTION (2.35 Å)
Cite:Crystal structure of a novel PU plastic degradation urethanase UMG-SP2 mutant from uncultured bacterium
To Be Published
8XRZ
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BU of 8xrz by Molmil
Crystal structure of a novel PU plastic degradation enzyme with ligand from Thermaerobacter marianensis
Descriptor: 4-oxidanylbutyl ~{N}-[4-[(4-aminophenyl)methyl]phenyl]carbamate, Carboxylic ester hydrolase, SULFATE ION
Authors:Li, Z.S, Wang, H, Zheng, Z.R, Cong, L, Chen, Y.Y, Han, X, Wei, R, Uwe, B, liu, W.D.
Deposit date:2024-01-08
Release date:2025-01-15
Method:X-RAY DIFFRACTION (2.11 Å)
Cite:Crystal structure of a novel PU plastic degradation enzyme with ligand from Thermaerobacter marianensis
To Be Published
5M00
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BU of 5m00 by Molmil
Crystal structure of murine P14 TCR complex with H-2Db and Y4A, modified gp33 peptide from LCMV
Descriptor: Beta-2-microglobulin, H-2 class I histocompatibility antigen, D-B alpha chain, ...
Authors:Achour, A, Sandalova, T, Sun, R, Han, X.
Deposit date:2016-10-03
Release date:2017-12-20
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Thernary complexes of TCR P14 give insights into the mechanisms behind reestablishment of CTL responses against a viral escape mutant
To Be Published
5M01
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BU of 5m01 by Molmil
Crystal structure of murine P14 TCR/ H-2Db complex with PA, modified gp33 peptide from LCMV
Descriptor: Beta-2-microglobulin, GLYCEROL, H-2 class I histocompatibility antigen, ...
Authors:Achour, A, Sandalova, T, Sun, R, Han, X.
Deposit date:2016-10-03
Release date:2017-10-25
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Thernary complexes of TCR P14 give insights into the mechanisms behind reestablishment of CTL responses against a viral escape mutant
To Be Published
8YMA
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BU of 8yma by Molmil
CRYSTAL STRUCTURE OF A NOVEL PU PLASTIC DEGRADATION ENZYME FROM THERMAEROBACTER MARIANENSIS
Descriptor: Carboxylic ester hydrolase, SULFATE ION
Authors:Li, Z.S, Wang, H, Gao, J, Chen, Y.Y, Wei, H.L, Han, X, Wei, R, Bornscheuer, U.T, Liu, W.D.
Deposit date:2024-03-08
Release date:2025-03-12
Method:X-RAY DIFFRACTION (2.07 Å)
Cite:CRYSTAL STRUCTURE OF A NOVEL PU PLASTIC DEGRADATION ENZYME FROM THERMAEROBACTER MARIANENSIS
To Be Published
7ARM
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BU of 7arm by Molmil
LolCDE in complex with lipoprotein and LolA
Descriptor: (2S)-3-hydroxypropane-1,2-diyl dihexadecanoate, LPP, Lipoprotein-releasing ABC transporter permease subunit LolC, ...
Authors:Tang, X.D, Chang, S.H, Zhang, K, Wang, T, Luo, Q.H, Qiao, W, Wang, C, Shen, C.R, Zhang, Z.B, Zhang, Z.Y, Zhu, X.F, Wei, X.W, Dong, C.J, Zhang, X, Dong, H.H.
Deposit date:2020-10-25
Release date:2021-04-07
Last modified:2024-11-13
Method:ELECTRON MICROSCOPY (3.6 Å)
Cite:Structural basis for bacterial lipoprotein relocation by the transporter LolCDE.
Nat.Struct.Mol.Biol., 28, 2021
7ARL
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BU of 7arl by Molmil
LolCDE in complex with lipoprotein and ADP
Descriptor: (2S)-3-hydroxypropane-1,2-diyl dihexadecanoate, ADENOSINE-5'-DIPHOSPHATE, LPP, ...
Authors:Tang, X.D, Chang, S.H, Zhang, K, Wang, T, Luo, Q.H, Qiao, W, Wang, C, Shen, C.R, Zhang, Z.B, Zhang, Z.Y, Zhu, X.F, Wei, X.W, Dong, C.J, Zhang, X, Dong, H.H.
Deposit date:2020-10-25
Release date:2021-04-07
Last modified:2024-10-09
Method:ELECTRON MICROSCOPY (3.2 Å)
Cite:Structural basis for bacterial lipoprotein relocation by the transporter LolCDE.
Nat.Struct.Mol.Biol., 28, 2021
7ARI
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BU of 7ari by Molmil
LolCDE apo structure
Descriptor: Lipoprotein-releasing ABC transporter permease subunit LolC, Lipoprotein-releasing system ATP-binding protein LolD, Lipoprotein-releasing system transmembrane protein LolE
Authors:Tang, X.D, Chang, S.H, Zhang, K, Wang, T, Luo, Q.H, Qiao, W, Wang, C, Zhang, Z.B, Zhang, Z.Y, Zhu, X.F, Dong, C.J, Zhang, X, Dong, H.H.
Deposit date:2020-10-25
Release date:2021-04-07
Last modified:2025-07-02
Method:ELECTRON MICROSCOPY (3.4 Å)
Cite:Structural basis for bacterial lipoprotein relocation by the transporter LolCDE.
Nat.Struct.Mol.Biol., 28, 2021
7ARK
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BU of 7ark by Molmil
LolCDE in complex with AMP-PNP in the closed NBD state
Descriptor: Lipoprotein-releasing ABC transporter permease subunit LolC, Lipoprotein-releasing system ATP-binding protein LolD, Lipoprotein-releasing system transmembrane protein LolE, ...
Authors:Tang, X.D, Chang, S.H, Zhang, K, Wang, T, Luo, Q.H, Qiao, W, Wang, C, Zhang, Z.B, Zhang, Z.Y, Zhu, X.F, Dong, C.J, Zhang, X, Dong, H.H.
Deposit date:2020-10-25
Release date:2021-04-07
Last modified:2024-05-01
Method:ELECTRON MICROSCOPY (4.1 Å)
Cite:Structural basis for bacterial lipoprotein relocation by the transporter LolCDE.
Nat.Struct.Mol.Biol., 28, 2021
7ARH
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BU of 7arh by Molmil
LolCDE in complex with lipoprotein
Descriptor: (2S)-3-hydroxypropane-1,2-diyl dihexadecanoate, LPP, Lipoprotein-releasing ABC transporter permease subunit LolC, ...
Authors:Tang, X.D, Chang, S.H, Zhang, K, Wang, T, Luo, Q.H, Qiao, W, Wang, C, Zhang, Z.B, Zhang, Z.Y, Zhu, X.F, Dong, C.J, Zhang, X, Dong, H.H.
Deposit date:2020-10-25
Release date:2021-04-07
Last modified:2025-07-09
Method:ELECTRON MICROSCOPY (3.3 Å)
Cite:Structural basis for bacterial lipoprotein relocation by the transporter LolCDE.
Nat.Struct.Mol.Biol., 28, 2021
7ARJ
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BU of 7arj by Molmil
LolCDE in complex with lipoprotein and AMPPNP complex undimerized form
Descriptor: (2S)-3-hydroxypropane-1,2-diyl dihexadecanoate, LPP, Lipoprotein-releasing ABC transporter permease subunit LolC, ...
Authors:Tang, X.D, Chang, S.H, Zhang, K, Wang, T, Luo, Q.H, Qiao, W, Wang, C, Zhang, Z.B, Zhang, Z.Y, Zhu, X.F, Dong, C.J, Zhang, X, Dong, H.H.
Deposit date:2020-10-25
Release date:2021-04-07
Last modified:2024-10-23
Method:ELECTRON MICROSCOPY (3.2 Å)
Cite:Structural basis for bacterial lipoprotein relocation by the transporter LolCDE.
Nat.Struct.Mol.Biol., 28, 2021
8ZQ7
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BU of 8zq7 by Molmil
Crystal structure of prefusion RSV F protein
Descriptor: Fusion glycoprotein F0,Fibritin
Authors:Huang, Q, Lang, Q, Han, X, Yan, J.
Deposit date:2024-06-01
Release date:2025-06-04
Method:X-RAY DIFFRACTION (2.77 Å)
Cite:preF8P of RSV glycoprotein F0
To Be Published
1NP5
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BU of 1np5 by Molmil
(GAC)3 parallel duplex
Descriptor: 5'-D(*GP*AP*CP*GP*AP*CP*GP*AP*C)-3'
Authors:Zheng, M, Han, X, Gao, X.
Deposit date:2003-01-17
Release date:2003-02-11
Last modified:2024-05-22
Method:SOLUTION NMR
Cite:Strand polarity of trinucleotide repeat sequences: NMR studies of parallel/anti-pararell duplex,{d(GAC)3}2
To be Published
8IJT
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BU of 8ijt by Molmil
crystal structure of Hyp N135A mutant from Hypoxylon sp. E7406B
Descriptor: Terpene synthase
Authors:Gao, J, Su, L.Q, Li, Q, Han, X, Wei, H.L, Dai, Z.J, Liu, W.D.
Deposit date:2023-02-28
Release date:2024-02-28
Method:X-RAY DIFFRACTION (2.56 Å)
Cite:crystal structure of Hyp N135A mutant from Hypoxylon sp. E7406B
to be published
8II9
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BU of 8ii9 by Molmil
crystal structure of Hyp mutant from Hypoxylon sp. E7406B
Descriptor: Terpene synthase
Authors:Gao, J, Liu, W.D, Li, Q, Han, X, Wei, H.L, Dai, Z.J, Su, L.Q.
Deposit date:2023-02-24
Release date:2024-02-28
Method:X-RAY DIFFRACTION (2.17 Å)
Cite:crystal structure of Hyp
to be published
1CX5
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BU of 1cx5 by Molmil
ANTISENSE DNA/RNA HYBRID CONTAINING MODIFIED BACKBONE
Descriptor: 5'-D(*CP*GP*CP*GP*TP*T*(MMT)P*TP*GP*CP*GP*C), 5'-R(*GP*CP*GP*CP*AP*AP*AP*AP*CP*GP*CP*G)
Authors:Yang, X, Han, X, Cross, C, Sanghvi, Y, Gao, X.
Deposit date:1999-08-28
Release date:1999-09-14
Last modified:2024-05-22
Method:SOLUTION NMR
Cite:NMR structure of an antisense DNA.RNA hybrid duplex containing a 3'-CH(2)N(CH(3))-O-5' or an MMI backbone linker.
Biochemistry, 38, 1999
8H8Y
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BU of 8h8y by Molmil
Crystal structure of AbHheG from Acidimicrobiia bacterium
Descriptor: GLYCEROL, alpha/beta hydrolase
Authors:Zhou, C.H, Chen, X, Han, X, Liu, W.D, Wu, Q.Q, Zhu, D.M, Ma, Y.H.
Deposit date:2022-10-24
Release date:2023-08-02
Last modified:2024-05-29
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Flipping the Substrate Creates a Highly Selective Halohydrin Dehalogenase for the Synthesis of Chiral 4-Aryl-2-oxazolidinones from Readily Available Epoxides
Acs Catalysis, 13, 2023
8WDM
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BU of 8wdm by Molmil
Crystal structure of a novel PU plastic degradation enzyme from Thermaerobacter marianensis
Descriptor: Carboxylic ester hydrolase
Authors:Li, Z.S, Wang, H, Gao, J, Chen, Y.Y, Wei, H.L, Li, Q, Han, X, Wei, R, Liu, W.D.
Deposit date:2023-09-15
Release date:2024-09-18
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Crystal structure of a novel PU plastic degradation enzyme from Thermaerobacter marianensis
To Be Published
8WDW
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BU of 8wdw by Molmil
Crystal structure of a novel PU plastic degradation urethanase UMG-SP2 from uncultured bacterium
Descriptor: GLYCEROL, SULFATE ION, UMG-SP2, ...
Authors:Cong, L, Li, Z.S, Gao, J, Li, Q, Chen, Y.Y, Han, X, Gert, W, Wei, R, Liu, W.D, Bornscheuer, U.T.
Deposit date:2023-09-16
Release date:2024-09-18
Last modified:2025-04-23
Method:X-RAY DIFFRACTION (2.16 Å)
Cite:Structure-Guided Engineering of a Versatile Urethanase Improves Its Polyurethane Depolymerization Activity.
Adv Sci, 12, 2025
9IK1
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BU of 9ik1 by Molmil
Cryo-EM structure of the human P2X3 receptor-compound 26a complex
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 4-[2-cyclopropyl-7-[[(1~{R})-1-naphthalen-2-ylethyl]amino]-[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]piperazine-1-carboxamide, ADENOSINE-5'-TRIPHOSPHATE, ...
Authors:Kim, S, Kim, G.R, Kim, Y.O, Han, X, Nagel, J, Kim, J, Song, D.I, Muller, C.E, Yoon, M.H, Jin, M.S, Kim, Y.C.
Deposit date:2024-06-26
Release date:2024-09-04
Last modified:2025-07-02
Method:ELECTRON MICROSCOPY (2.61 Å)
Cite:Discovery of Triazolopyrimidine Derivatives as Selective P2X3 Receptor Antagonists Binding to an Unprecedented Allosteric Site as Evidenced by Cryo-Electron Microscopy.
J.Med.Chem., 67, 2024
8HQP
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BU of 8hqp by Molmil
Crystal structure of AbHheG mutant from Acidimicrobiia bacterium
Descriptor: AbHheG_m
Authors:Zhou, C.H, Chen, X, Han, X, Liu, W.D, Wu, Q.Q, Zhu, D.M, Ma, Y.H.
Deposit date:2022-12-13
Release date:2023-08-02
Last modified:2024-05-29
Method:X-RAY DIFFRACTION (1.62 Å)
Cite:Flipping the Substrate Creates a Highly Selective Halohydrin Dehalogenase for the Synthesis of Chiral 4-Aryl-2-oxazolidinones from Readily Available Epoxides
Acs Catalysis, 13, 2023

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数据于2025-07-23公开中

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