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7X0Q
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BU of 7x0q by Molmil
Crystal structure of ATPase Clo1313_2554 from Clostridium thermocellum
Descriptor: ABC transporter related protein
Authors:Dong, S, Yao, X, Feng, Y.
Deposit date:2022-02-22
Release date:2022-09-14
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Deciphering Cellodextrin and Glucose Uptake in Clostridium thermocellum.
Mbio, 13, 2022
7X0R
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BU of 7x0r by Molmil
Crystal structure of substrate binding protein Lbp complexed wtih guanosine from Clostridium thermocellum
Descriptor: GUANOSINE, Lbp, ZINC ION
Authors:Dong, S, Yao, X, Feng, Y.
Deposit date:2022-02-22
Release date:2022-09-14
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.47 Å)
Cite:Deciphering Cellodextrin and Glucose Uptake in Clostridium thermocellum.
Mbio, 13, 2022
7X0I
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BU of 7x0i by Molmil
Crystal structure of sugar binding protein CbpB from Clostridium thermocellum
Descriptor: CbpB
Authors:Dong, S, Yao, X, Feng, Y.
Deposit date:2022-02-22
Release date:2022-09-14
Last modified:2024-05-29
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Deciphering Cellodextrin and Glucose Uptake in Clostridium thermocellum.
Mbio, 13, 2022
7X0N
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BU of 7x0n by Molmil
Crystal structure of sugar binding protein CbpB complexed wtih laminaribiose from Clostridium thermocellum
Descriptor: CbpB, beta-D-glucopyranose-(1-3)-beta-D-glucopyranose
Authors:Dong, S, Yao, X, Feng, Y.
Deposit date:2022-02-22
Release date:2022-09-14
Last modified:2024-05-29
Method:X-RAY DIFFRACTION (1.68 Å)
Cite:Deciphering Cellodextrin and Glucose Uptake in Clostridium thermocellum.
Mbio, 13, 2022
7X0J
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BU of 7x0j by Molmil
Crystal structure of sugar binding protein CbpB complexed wtih cellobiose from Clostridium thermocellum
Descriptor: CbpB, beta-D-glucopyranose-(1-4)-beta-D-glucopyranose
Authors:Dong, S, Yao, X, Feng, Y.
Deposit date:2022-02-22
Release date:2022-09-14
Last modified:2024-05-29
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Deciphering Cellodextrin and Glucose Uptake in Clostridium thermocellum.
Mbio, 13, 2022
7W06
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BU of 7w06 by Molmil
Itaconate inducible LysR-Type Transcriptional regulator (ITCR) in complex with itaconate (SeMet labeled), Space group C121.
Descriptor: 2-methylidenebutanedioic acid, CHLORIDE ION, SULFATE ION, ...
Authors:Sun, P.K, Wang, B, Wang, Z.X, Qi, S, Li, X.J.
Deposit date:2021-11-17
Release date:2022-10-26
Last modified:2024-11-13
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:A genetically encoded fluorescent biosensor for detecting itaconate with subcellular resolution in living macrophages.
Nat Commun, 13, 2022
7W07
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BU of 7w07 by Molmil
Itaconate inducible LysR-Type Transcriptional regulator (ITCR) in complex with itaconate, Space group C121.
Descriptor: 2-methylidenebutanedioic acid, SULFATE ION, Transcriptional regulator, ...
Authors:Sun, P.K, Wang, B, Li, X.J.
Deposit date:2021-11-17
Release date:2022-10-26
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.48 Å)
Cite:A genetically encoded fluorescent biosensor for detecting itaconate with subcellular resolution in living macrophages.
Nat Commun, 13, 2022
7W08
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BU of 7w08 by Molmil
Itaconate inducible LysR-Type Transcriptional regulator (ITCR) in APO form, Space group P1.
Descriptor: Transcriptional regulator, LysR family
Authors:Sun, P.K, Wang, B, Li, X.J.
Deposit date:2021-11-17
Release date:2022-10-26
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (3.25 Å)
Cite:A genetically encoded fluorescent biosensor for detecting itaconate with subcellular resolution in living macrophages.
Nat Commun, 13, 2022
7X0M
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BU of 7x0m by Molmil
Crystal structure of sugar binding protein CbpB complexed wtih cellopentaose from Clostridium thermocellum
Descriptor: CbpB, beta-D-glucopyranose-(1-4)-beta-D-glucopyranose-(1-4)-beta-D-glucopyranose-(1-4)-beta-D-glucopyranose-(1-4)-beta-D-glucopyranose
Authors:Dong, S, Yao, X, Feng, Y.
Deposit date:2022-02-22
Release date:2022-09-14
Last modified:2024-05-29
Method:X-RAY DIFFRACTION (2 Å)
Cite:Deciphering Cellodextrin and Glucose Uptake in Clostridium thermocellum.
Mbio, 13, 2022
7Y78
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BU of 7y78 by Molmil
Crystal structure of Cry78Aa
Descriptor: 1,2-ETHANEDIOL, AMMONIUM ION, Toxin
Authors:Cao, B.B, Nie, Y.F, Wang, N.C, Guan, Z.Y, Zhang, D.L, Zhang, J.
Deposit date:2022-06-21
Release date:2022-08-31
Last modified:2024-05-29
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:The crystal structure of Cry78Aa from Bacillus thuringiensis provides insights into its insecticidal activity.
Commun Biol, 5, 2022
7Y79
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BU of 7y79 by Molmil
Crystal structure of Cry78Aa
Descriptor: Toxin
Authors:Cao, B.B, Nie, Y.F, Wang, N.C, Guan, Z.Y, Zhang, D.L, Zhang, J.
Deposit date:2022-06-21
Release date:2022-08-31
Last modified:2024-05-29
Method:X-RAY DIFFRACTION (2.32 Å)
Cite:The crystal structure of Cry78Aa from Bacillus thuringiensis provides insights into its insecticidal activity.
Commun Biol, 5, 2022
8RIY
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BU of 8riy by Molmil
Human NUDT5 with ibrutinib derivative
Descriptor: 1-(1-methylpiperidin-4-yl)-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine, ADP-sugar pyrophosphatase
Authors:Balikci-Akil, E, Elkins, J.M, Huber, K.V.M.
Deposit date:2023-12-19
Release date:2024-05-01
Last modified:2024-05-22
Method:X-RAY DIFFRACTION (2.288 Å)
Cite:Unexpected Noncovalent Off-Target Activity of Clinical BTK Inhibitors Leads to Discovery of a Dual NUDT5/14 Antagonist.
J.Med.Chem., 67, 2024
8RDZ
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BU of 8rdz by Molmil
Crystal Structure of Human ADP-ribose Pyrophosphatase NUDT5 In complex with Ibrutinib
Descriptor: 1,2-ETHANEDIOL, ADP-sugar pyrophosphatase, Ibrutinib (unbound form), ...
Authors:Raux, B, Huber, K.V.M.
Deposit date:2023-12-09
Release date:2024-05-01
Last modified:2024-05-22
Method:X-RAY DIFFRACTION (2.02 Å)
Cite:Unexpected Noncovalent Off-Target Activity of Clinical BTK Inhibitors Leads to Discovery of a Dual NUDT5/14 Antagonist.
J.Med.Chem., 67, 2024
6IVU
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BU of 6ivu by Molmil
Solution structure of the Sigma-anti-sigma factor complex RsgI1N-SigI1C from Clostridium thermocellum
Descriptor: Anti-sigma-I factor RsgI1, RNA polymerase sigma factor SigI1
Authors:Wei, Z, Feng, Y.
Deposit date:2018-12-04
Release date:2019-05-15
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:Alternative sigma I/anti-sigma I factors represent a unique form of bacterial sigma /anti-sigma complex.
Nucleic Acids Res., 47, 2019
6IVS
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BU of 6ivs by Molmil
Solution structure of the N-terminal domain of the anti-sigma factor RsgI1 from Clostridium thermocellum
Descriptor: Anti-sigma-I factor RsgI1
Authors:Wei, Z, Feng, Y.
Deposit date:2018-12-04
Release date:2019-05-15
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:Alternative sigma I/anti-sigma I factors represent a unique form of bacterial sigma /anti-sigma complex.
Nucleic Acids Res., 47, 2019
3OMC
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BU of 3omc by Molmil
Structure of human SND1 extended tudor domain in complex with the symmetrically dimethylated arginine PIWIL1 peptide R4me2s
Descriptor: CHLORIDE ION, SYNTHETIC PEPTIDE, Staphylococcal nuclease domain-containing protein 1
Authors:Lam, R, Liu, K, Guo, Y.H, Bian, C.B, Xu, C, MacKenzie, F, Bountra, C, Weigelt, J, Arrowsmith, C.H, Edwards, A.M, Bochkarev, A, Min, J, Structural Genomics Consortium (SGC)
Deposit date:2010-08-26
Release date:2010-09-15
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (1.77 Å)
Cite:Structural basis for recognition of arginine methylated Piwi proteins by the extended Tudor domain.
Proc.Natl.Acad.Sci.USA, 107, 2010
7CMA
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BU of 7cma by Molmil
Structure of A151R from African swine fever virus Georgia
Descriptor: A151R, ZINC ION
Authors:Niu, D, Liu, K, Huang, J, Chen, C, Liu, W, Guo, R.
Deposit date:2020-07-26
Release date:2021-06-02
Last modified:2024-03-27
Method:X-RAY DIFFRACTION (2.01 Å)
Cite:Structure basis of non-structural protein pA151R from African Swine Fever Virus.
Biochem.Biophys.Res.Commun., 532, 2020
8JIX
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BU of 8jix by Molmil
Crystal structure of the Bagaza virus helicase and structure-based discovery of a novel inhibitor
Descriptor: Genome polyprotein
Authors:Zhao, R, Shu, W, Cao, J.M, Zhou, X, Wang, D.P.
Deposit date:2023-05-29
Release date:2024-03-06
Last modified:2025-05-28
Method:X-RAY DIFFRACTION (1.71 Å)
Cite:Structure-based discovery of dual-target inhibitors of the helicase from bagaza virus.
Int.J.Biol.Macromol., 294, 2025
7DCD
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BU of 7dcd by Molmil
Nonstructural protein 7 and 8 complex of SARS-CoV-2
Descriptor: Non-structural protein 7, Non-structural protein 8
Authors:Zhang, C.H, Li, L, Su, D.
Deposit date:2020-10-24
Release date:2021-03-24
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (2.57 Å)
Cite:Nonstructural protein 7 and 8 complexes of SARS-CoV-2.
Protein Sci., 30, 2021
6ISU
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BU of 6isu by Molmil
Crystal structure of Lys27-linked di-ubiquitin in complex with its selective interacting protein UCHL3
Descriptor: Ubiquitin, Ubiquitin carboxyl-terminal hydrolase isozyme L3
Authors:Ding, S, Pan, M, Zheng, Q, Ren, Y, Hong, D.
Deposit date:2018-11-19
Release date:2019-02-06
Last modified:2024-11-13
Method:X-RAY DIFFRACTION (1.866 Å)
Cite:Chemical Protein Synthesis Enabled Mechanistic Studies on the Molecular Recognition of K27-linked Ubiquitin Chains.
Angew. Chem. Int. Ed. Engl., 58, 2019
7DD1
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BU of 7dd1 by Molmil
Crystal structure of SRPK1 in complex with a peptide inhibitor
Descriptor: ARG-GLU-ARG-ALA-ARG-THR-ARG, SRSF protein kinase 1,SRSF protein kinase 1
Authors:Li, Q.Y, Yung, K.W.Y, Ngo, J.C.K.
Deposit date:2020-10-27
Release date:2021-04-21
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.05 Å)
Cite:Protein-Protein Interaction Inhibitor of SRPKs Alters the Splicing Isoforms of VEGF and Inhibits Angiogenesis.
Iscience, 24, 2021
8K09
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BU of 8k09 by Molmil
Pq3-O-UGT2 with 20(S)-Ginsenoside F2
Descriptor: (2~{R},3~{S},4~{S},5~{R},6~{R})-2-(hydroxymethyl)-6-[[(3~{S},5~{R},8~{R},9~{R},10~{R},12~{R},13~{R},14~{R},17~{S})-17-[(2~{S})-2-[(2~{S},3~{R},4~{S},5~{S},6~{R})-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-6-methyl-hept-5-en-2-yl]-4,4,8,10,14-pentamethyl-12-oxidanyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1~{H}-cyclopenta[a]phenanthren-3-yl]oxy]oxane-3,4,5-triol, Glycosyltransferase
Authors:Mei, K.R, Ji, Q.S, Liu, Y.R.
Deposit date:2023-07-07
Release date:2025-01-29
Last modified:2025-04-02
Method:X-RAY DIFFRACTION (3.36 Å)
Cite:Structural Insights into the Substrate Recognition of Ginsenoside Glycosyltransferase Pq3-O-UGT2.
Adv Sci, 12, 2025
8JZQ
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BU of 8jzq by Molmil
Crystal structure of Panax quinquefolius Pq3-O-UGT2
Descriptor: Glycosyltransferase
Authors:Mei, K, Ji, Q, Liu, Y.
Deposit date:2023-07-06
Release date:2025-01-29
Last modified:2025-04-02
Method:X-RAY DIFFRACTION (2.89 Å)
Cite:Structural Insights into the Substrate Recognition of Ginsenoside Glycosyltransferase Pq3-O-UGT2.
Adv Sci, 12, 2025
8K08
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BU of 8k08 by Molmil
Pq3-O-UGT2 with 20(S)-Ginsenoside Rh2
Descriptor: Ginsenoside Rh2, Glycosyltransferase
Authors:Ji, Q.S, Liu, Y.R, Mei, K.R.
Deposit date:2023-07-07
Release date:2025-01-29
Last modified:2025-04-02
Method:X-RAY DIFFRACTION (3.5 Å)
Cite:Structural Insights into the Substrate Recognition of Ginsenoside Glycosyltransferase Pq3-O-UGT2.
Adv Sci, 12, 2025
6KG9
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BU of 6kg9 by Molmil
Solution structure of CaDoc0917 from Clostridium acetobutylicum
Descriptor: And cellulose-binding endoglucanase family 9 CelL ortholog dockerin domain, CALCIUM ION
Authors:Feng, Y, Yao, X.
Deposit date:2019-07-11
Release date:2020-07-08
Last modified:2024-05-01
Method:SOLUTION NMR
Cite:Discovery and mechanism of a pH-dependent dual-binding-site switch in the interaction of a pair of protein modules.
Sci Adv, 6, 2020

238582

数据于2025-07-09公开中

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