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7W15
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BU of 7w15 by Molmil
Crystal Structure of MPH-E in complex with GTP and Erythromycin
Descriptor: ERYTHROMYCIN A, GLYCEROL, GUANOSINE-5'-TRIPHOSPHATE, ...
Authors:Qi, Q, Kuang, L, Jiang, Y.
Deposit date:2021-11-19
Release date:2023-04-26
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.77 Å)
Cite:Crystal Structure of the Acinetobacter baumannii Macrolide Phosphotransferases E Reveal the Novel Catalysis Mechanism
To Be Published
7W1A
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BU of 7w1a by Molmil
Crystal Structure of MPH-E in complex with GMP and Azithromycin
Descriptor: AZITHROMYCIN, GUANOSINE, Macrolide 2'-phosphotransferase
Authors:Qi, Q, Kuang, L, Jiang, Y.
Deposit date:2021-11-19
Release date:2023-04-26
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.17 Å)
Cite:Crystal Structure of the Acinetobacter baumannii Macrolide Phosphotransferases E Reveal the Novel Catalysis Mechanism
To Be Published
7DW9
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BU of 7dw9 by Molmil
Cryo-EM structure of human V2 vasopressin receptor in complex with an Gs protein
Descriptor: CHOLESTEROL, CYS-TYR-PHE-GLN-ASN-CYS-PRO-ARG-GLY-NH2, Guanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2, ...
Authors:Zhou, F, Jiang, Y.
Deposit date:2021-01-15
Release date:2021-07-21
Last modified:2022-02-16
Method:ELECTRON MICROSCOPY (2.6 Å)
Cite:Molecular basis of ligand recognition and activation of human V2 vasopressin receptor.
Cell Res., 31, 2021
7FHN
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BU of 7fhn by Molmil
Structure of AtTPC1 D240A/D454A/E528A mutant with 1 mM Ca2+
Descriptor: CALCIUM ION, Two pore calcium channel protein 1,GFP
Authors:Ye, F, Xu, L, Li, X, Jiang, Y, Guo, J.
Deposit date:2021-07-29
Release date:2021-12-01
Last modified:2022-03-16
Method:ELECTRON MICROSCOPY (3.3 Å)
Cite:Voltage-gating and cytosolic Ca 2+ activation mechanisms of Arabidopsis two-pore channel AtTPC1.
Proc.Natl.Acad.Sci.USA, 118, 2021
7FHO
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BU of 7fho by Molmil
Structure of AtTPC1 D240A/D454A/E528A mutant with 50 mM Ca2+
Descriptor: CALCIUM ION, Two pore calcium channel protein 1,GFP
Authors:Ye, F, Xu, L, Li, X, Jiang, Y, Guo, J.
Deposit date:2021-07-29
Release date:2021-12-01
Last modified:2022-03-16
Method:ELECTRON MICROSCOPY (2.8 Å)
Cite:Voltage-gating and cytosolic Ca 2+ activation mechanisms of Arabidopsis two-pore channel AtTPC1.
Proc.Natl.Acad.Sci.USA, 118, 2021
7FHK
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BU of 7fhk by Molmil
Structure of AtTPC1 with 1 mM Ca2+
Descriptor: AtTPC1-Cter, CALCIUM ION, Two pore calcium channel protein 1,GFP
Authors:Ye, F, Xu, L, Li, X, Jiang, Y, Guo, J.
Deposit date:2021-07-29
Release date:2021-12-01
Last modified:2024-06-12
Method:ELECTRON MICROSCOPY (3.3 Å)
Cite:Voltage-gating and cytosolic Ca 2+ activation mechanisms of Arabidopsis two-pore channel AtTPC1.
Proc.Natl.Acad.Sci.USA, 118, 2021
7FHL
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BU of 7fhl by Molmil
Structure of AtTPC1 with 50 mM Ca2+
Descriptor: AtTPC1-Cter, CALCIUM ION, Two pore calcium channel protein 1,GFP
Authors:Ye, F, Xu, L, Li, X, Jiang, Y, Guo, J.
Deposit date:2021-07-29
Release date:2021-12-01
Last modified:2022-03-16
Method:ELECTRON MICROSCOPY (3.1 Å)
Cite:Voltage-gating and cytosolic Ca 2+ activation mechanisms of Arabidopsis two-pore channel AtTPC1.
Proc.Natl.Acad.Sci.USA, 118, 2021
6AH7
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BU of 6ah7 by Molmil
D45W/H226G mutant of marine bacterial prolidase
Descriptor: MANGANESE (II) ION, SODIUM ION, SULFATE ION, ...
Authors:Jian, Y, Yunzhu, X, Lijuan, L.
Deposit date:2018-08-17
Release date:2019-09-18
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.38 Å)
Cite:Repurposing a bacterial prolidase for organophosphorus hydrolysis: Reshaped catalytic cavity switches substrate selectivity.
Biotechnol.Bioeng., 117, 2020
6AH8
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BU of 6ah8 by Molmil
Marine bacterial prolidase with promiscuous organophosphorus hydrolase activity
Descriptor: MANGANESE (II) ION, SULFATE ION, Xaa-Pro dipeptidase
Authors:Jian, Y.
Deposit date:2018-08-17
Release date:2019-09-18
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.61 Å)
Cite:Repurposing a bacterial prolidase for organophosphorus hydrolysis: Reshaped catalytic cavity switches substrate selectivity.
Biotechnol.Bioeng., 117, 2020
6KNE
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BU of 6kne by Molmil
The C-terminal Domain of Translation Initiation Factor 5 at high pH
Descriptor: Translation initiation factor eIF5
Authors:Jian, Y, YuXin, Y, Min, Y.
Deposit date:2019-08-05
Release date:2020-06-17
Last modified:2024-03-27
Method:X-RAY DIFFRACTION (1.701 Å)
Cite:The pH-dependent conformational change of eukaryotic translation initiation factor 5: Insights into partner-binding manner.
Biochem.Biophys.Res.Commun., 519, 2019
6KND
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BU of 6knd by Molmil
The C-terminal Domain of Translation Initiation Factor 5 at low pH
Descriptor: Translation initiation factor eIF5
Authors:Jian, Y, YuXin, Y, Min, Y.
Deposit date:2019-08-05
Release date:2020-06-17
Last modified:2024-03-27
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:The pH-dependent conformational change of eukaryotic translation initiation factor 5: Insights into partner-binding manner.
Biochem.Biophys.Res.Commun., 519, 2019
5ZQ8
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BU of 5zq8 by Molmil
Crystal structure of spRlmCD with U747 stemloop RNA
Descriptor: NICKEL (II) ION, RNA (5'-R(*CP*CP*GP*UP*(MUM)P*GP*AP*AP*AP*AP*GP*G)-3'), S-ADENOSYL-L-HOMOCYSTEINE, ...
Authors:Jiang, Y.Y, Yu, H.L.
Deposit date:2018-04-17
Release date:2018-10-24
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.18 Å)
Cite:Unveiling the structural features that determine the dual methyltransferase activities of Streptococcus pneumoniae RlmCD
PLoS Pathog., 14, 2018
5ZTH
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BU of 5zth by Molmil
Crystal structure of spRlmCD with U1939loop RNA at 3.24 angstrom
Descriptor: RNA (5'-R(P*AP*AP*AP*(MUM)P*UP*CP*CP*U)-3'), S-ADENOSYL-L-HOMOCYSTEINE, Uncharacterized RNA methyltransferase SP_1029
Authors:Jiang, Y.Y, Yu, H.L.
Deposit date:2018-05-03
Release date:2018-10-24
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (3.24 Å)
Cite:Unveiling the structural features that determine the dual methyltransferase activities of Streptococcus pneumoniae RlmCD
PLoS Pathog., 14, 2018
5XIW
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BU of 5xiw by Molmil
Crystal structure of T2R-TTL-Colchicine complex
Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, CALCIUM ION, GLYCEROL, ...
Authors:Wang, Y, Yang, J, Wang, T, Chen, L.
Deposit date:2017-04-27
Release date:2018-04-18
Last modified:2024-03-27
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:The compound millepachine and its derivatives inhibit tubulin polymerization by irreversibly binding to the colchicine-binding site in beta-tubulin.
J. Biol. Chem., 2018
5XP3
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BU of 5xp3 by Molmil
Crystal structure of apo T2R-TTL
Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, CALCIUM ION, GLYCEROL, ...
Authors:Wang, Y, Yang, J, Wang, T, Chen, L.
Deposit date:2017-05-31
Release date:2017-10-25
Last modified:2024-03-27
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:The compound millepachine and its derivatives inhibit tubulin polymerization by irreversibly binding to the colchicine-binding site in beta-tubulin.
J. Biol. Chem., 2018
5YL2
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BU of 5yl2 by Molmil
Crystal structure of T2R-TTL-Y28 complex
Descriptor: (E)-1-(5-methoxy-2,2-dimethyl-chromen-8-yl)-3-(4-methoxy-3-oxidanyl-phenyl)prop-2-en-1-one, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, CALCIUM ION, ...
Authors:Yang, J.H, Yang, T, Wen, J.L, Chen, L.J.
Deposit date:2017-10-16
Release date:2018-04-18
Last modified:2024-03-27
Method:X-RAY DIFFRACTION (2.09 Å)
Cite:The compound millepachine and its derivatives inhibit tubulin polymerization by irreversibly binding to the colchicine-binding site in beta-tubulin.
J. Biol. Chem., 2018
5ZQ1
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BU of 5zq1 by Molmil
Crystal structure of spRlmCD with U1939loop RNA at 3.10 angstrom
Descriptor: RNA (5'-R(*AP*AP*AP*(MUM)P*UP*CP*CP*U)-3'), S-ADENOSYL-L-HOMOCYSTEINE, Uncharacterized RNA methyltransferase SP_1029
Authors:Yu, H.L, Jiang, Y.Y.
Deposit date:2018-04-17
Release date:2018-10-24
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (3.1 Å)
Cite:Unveiling the structural features that determine the dual methyltransferase activities of Streptococcus pneumoniae RlmCD
PLoS Pathog., 14, 2018
5ZQ0
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BU of 5zq0 by Molmil
Crystal structure of spRlmCD with U747loop RNA
Descriptor: RNA (5'-R(*GP*UP*(MUM)P*GP*AP*AP*AP*A)-3'), S-ADENOSYL-L-HOMOCYSTEINE, Uncharacterized RNA methyltransferase SP_1029
Authors:Jiang, Y.Y, Yu, H.L.
Deposit date:2018-04-17
Release date:2018-10-24
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2 Å)
Cite:Unveiling the structural features that determine the dual methyltransferase activities of Streptococcus pneumoniae RlmCD
PLoS Pathog., 14, 2018
6L5Z
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BU of 6l5z by Molmil
Crystal strucutre of AF9 YEATS domain in complex with a cyclopeptide inhibitor
Descriptor: Protein AF-9, SC0-ALO-ALA-SC3-SC4-NH2
Authors:Li, Y, Chen, G, Li, H.
Deposit date:2019-10-25
Release date:2020-10-28
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (3.05 Å)
Cite:Selective Targeting of AF9 YEATS Domain by Cyclopeptide Inhibitors with Preorganized Conformation.
J.Am.Chem.Soc., 142, 2020
4KTC
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BU of 4ktc by Molmil
NS3/NS4A protease with inhibitor
Descriptor: (2R,6S,13aR,14aR,16aS)-6-{[(cyclopentyloxy)carbonyl]amino}-14a-[(cyclopropylsulfonyl)carbamoyl]-5,16-dioxooctadecahydrocyclopropa[e]pyrrolo[1,2-a][1,4]diazacyclopentadecin-2-yl 3,4-dihydroisoquinoline-2(1H)-carboxylate, NS4A peptide, Serine protease NS3, ...
Authors:Zhang, H, Ballard, J, Vigers, G.P.A, Brandhuber, B.J.
Deposit date:2013-05-20
Release date:2013-08-07
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Discovery of Danoprevir (ITMN-191/R7227), a Highly Selective and Potent Inhibitor of Hepatitis C Virus (HCV) NS3/4A Protease.
J.Med.Chem., 57, 2014
8K2E
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BU of 8k2e by Molmil
Crystal structure of YTHDC1 and Y3 complex
Descriptor: 2-chloranyl-6-(4-fluoranylphenoxy)benzoic acid, SULFATE ION, YTH domain-containing protein 1
Authors:Zhang, H.L, Yang, S.Y.
Deposit date:2023-07-12
Release date:2024-07-17
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:PocketFlow is a data-and-knowledge-driven structure-based molecular generative model
Nat. Mach. Intell., 6, 2024
7XL5
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BU of 7xl5 by Molmil
Crystal structure of the H42T/A85G/I86A mutant of a nadp-dependent alcohol dehydrogenase
Descriptor: NADP-dependent isopropanol dehydrogenase
Authors:Jiang, Y.Y, Qu, G, Li, X, Sun, Z.T, Han, X, Liu, W.D.
Deposit date:2022-04-21
Release date:2023-05-31
Last modified:2024-06-12
Method:X-RAY DIFFRACTION (2.604 Å)
Cite:Engineering the hydrogen transfer pathway of an alcohol dehydrogenase to increase activity by rational enzyme design
Mol Catal, 530, 2022
6NT4
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BU of 6nt4 by Molmil
Cryo-EM structure of a human-cockroach hybrid Nav channel bound to alpha-scorpion toxin AaH2.
Descriptor: (7E,21R,24S)-27-amino-24-hydroxy-18,24-dioxo-19,23,25-trioxa-24lambda~5~-phosphaheptacos-7-en-21-yl (9Z,12E)-octadeca-9,12-dienoate, 1,2-DIPALMITOYL-PHOSPHATIDYL-GLYCEROLE, 2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:Clairfeuille, T, Rohou, A, Payandeh, J.
Deposit date:2019-01-28
Release date:2019-02-20
Last modified:2021-08-25
Method:ELECTRON MICROSCOPY (3.5 Å)
Cite:Structural basis of alpha-scorpion toxin action on Na v channels.
Science, 363, 2019
7EIU
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BU of 7eiu by Molmil
Crystal structure of Mei2 RRM3 in complex with 8mer meiRNA
Descriptor: GLYCEROL, Meiosis protein mei2, RNA (5'-R(P*UP*UP*CP*UP*GP*C)-3')
Authors:Shen, S.Y, Lv, M.Q.
Deposit date:2021-03-31
Release date:2022-04-06
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.349 Å)
Cite:Structural insights reveal the specific recognition of meiRNA by the Mei2 protein.
J Mol Cell Biol, 14, 2022
7EIO
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BU of 7eio by Molmil
Crystal Structure of Mei2 RRM3
Descriptor: GLYCEROL, Meiosis protein mei2, SULFATE ION
Authors:Shen, S.Y, Li, F.D.
Deposit date:2021-03-31
Release date:2022-04-06
Last modified:2024-05-29
Method:X-RAY DIFFRACTION (1.895 Å)
Cite:Structural insights reveal the specific recognition of meiRNA by the Mei2 protein.
J Mol Cell Biol, 14, 2022

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數據於2024-09-11公開中

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