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8JQK
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Crystal structure of a carbonyl reductase SSCR mutant from Sporobolomyces Salmonicolor
Descriptor: Aldehyde reductase 2
Authors:Zhang, H.L, Li, Q, Liu, W.D, Chen, X, Wu, Q.Q, Zhu, D.M.
Deposit date:2023-06-14
Release date:2023-12-27
Method:X-RAY DIFFRACTION (1.63 Å)
Cite:Engineering a Carbonyl Reductase to Simultaneously Increase Activity Toward Bulky Ketone and Isopropanol for Dynamic Kinetic Asymmetric Reduction via Enzymatic Hydrogen Transfer
Acs Catalysis, 13, 2023
8JQJ
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BU of 8jqj by Molmil
Crystal structure of carbonyl reductase SSCR mutant 1 from Sporobolomyces Salmonicolor
Descriptor: Aldehyde reductase 2
Authors:Zhang, H.L, Li, Q, Liu, W.D, Chen, X, Wu, Q.Q, Zhu, D.M.
Deposit date:2023-06-14
Release date:2023-12-27
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Engineering a Carbonyl Reductase to Simultaneously Increase Activity Toward Bulky Ketone and Isopropanol for Dynamic Kinetic Asymmetric Reduction via Enzymatic Hydrogen Transfer
Acs Catalysis, 13, 2023
8JQF
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BU of 8jqf by Molmil
Structure of CmCBDA in complex with Ni2+ and Glycerol
Descriptor: GLYCEROL, NICKEL (II) ION, SULFATE ION, ...
Authors:Li, X.
Deposit date:2023-06-14
Release date:2024-01-03
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:Structural Insights into the Catalytic Activity of Cyclobacterium marinum N -Acetylglucosamine Deacetylase.
J.Agric.Food Chem., 72, 2024
8JQE
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BU of 8jqe by Molmil
Structure of CmCBDA in complex with Mn2+ and glycerol
Descriptor: GLYCEROL, MANGANESE (II) ION, PHOSPHATE ION, ...
Authors:Li, X.
Deposit date:2023-06-14
Release date:2024-01-03
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (2.31 Å)
Cite:Structural Insights into the Catalytic Activity of Cyclobacterium marinum N -Acetylglucosamine Deacetylase.
J.Agric.Food Chem., 72, 2024
8JQ1
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BU of 8jq1 by Molmil
Solution NMR Structure of zinc fingers 1-2 (fragment 257-320) from human insulinoma-associated protein 1(INSM1)
Descriptor: Insulinoma-associated protein 1, ZINC ION
Authors:He, X.L, Yang, Y.H.
Deposit date:2023-06-13
Release date:2024-06-19
Method:SOLUTION NMR
Cite:Solution NMR Structure of zinc fingers 1-2 (fragment 257-320) from human insulinoma-associated protein 1(INSM1)
To Be Published
8JPY
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BU of 8jpy by Molmil
Solution NMR Structure of Zinc-fingers 1 and 2 (fragment 257-320) from human Insulinoma-associated protein 1(INSM1)
Descriptor: Insulinoma-associated protein 1, ZINC ION
Authors:He, X.L, Yang, Y.H.
Deposit date:2023-06-13
Release date:2024-06-19
Method:SOLUTION NMR
Cite:Solution NMR Structure of Zinc-fingers 1 and 2 (fragment 257-320) from human Insulinoma-associated protein 1(INSM1)
To Be Published
8JPX
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BU of 8jpx by Molmil
Cryo-EM structure of PfAgo-guide DNA-target DNA complex
Descriptor: Excess DNA, Guide DNA, MAGNESIUM ION, ...
Authors:Zhuang, L.
Deposit date:2023-06-13
Release date:2024-01-31
Last modified:2024-05-01
Method:ELECTRON MICROSCOPY (2.9 Å)
Cite:Molecular mechanism for target recognition, dimerization, and activation of Pyrococcus furiosus Argonaute.
Mol.Cell, 84, 2024
8JPW
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BU of 8jpw by Molmil
Crystal Structure of Single-chain L-Glutamate Oxidase Mutant from Streptomyces sp. X-119-6
Descriptor: 2-OXOGLUTARIC ACID, FLAVIN-ADENINE DINUCLEOTIDE, L-glutamate oxidase, ...
Authors:Yamaguchi, H, Takahashi, K, Tatsumi, M, Tagami, U, Mizukoshi, T, Miyano, H, Sugiki, M.
Deposit date:2023-06-13
Release date:2023-08-09
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (2.66 Å)
Cite:Development of a novel single-chain l-glutamate oxidase from Streptomyces sp. X-119-6 by inserting flexible linkers.
Enzyme.Microb.Technol., 170, 2023
8JPQ
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BU of 8jpq by Molmil
SARS-CoV-2 Mpro in complex with D-5-96
Descriptor: ACETIC ACID, ALANINE, ISOLEUCINE, ...
Authors:Liu, M, Huang, H.
Deposit date:2023-06-12
Release date:2023-08-23
Last modified:2024-06-12
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:The S1'-S3' Pocket of the SARS-CoV-2 Main Protease Is Critical for Substrate Selectivity and Can Be Targeted with Covalent Inhibitors.
Angew.Chem.Int.Ed.Engl., 62, 2023
8JPG
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BU of 8jpg by Molmil
Cryo-EM structure of full-length ERGIC-53 with MCFD2
Descriptor: CALCIUM ION, Multiple coagulation factor deficiency protein 2, Protein ERGIC-53, ...
Authors:Watanabe, S, Inaba, K.
Deposit date:2023-06-12
Release date:2024-04-17
Method:ELECTRON MICROSCOPY (6.76 Å)
Cite:Structure of full-length ERGIC-53 in complex with MCFD2 for cargo transport.
Nat Commun, 15, 2024
8JPD
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BU of 8jpd by Molmil
Focused refinement structure of GRK2 in NTSR1-GRK2-Galpha(q) complexes
Descriptor: Beta-adrenergic receptor kinase 1, STAUROSPORINE
Authors:Duan, J, Liu, H, Zhao, F, Yuan, Q, Ji, Y, Xu, H.E.
Deposit date:2023-06-11
Release date:2023-08-09
Last modified:2023-08-30
Method:ELECTRON MICROSCOPY (2.81 Å)
Cite:GPCR activation and GRK2 assembly by a biased intracellular agonist.
Nature, 620, 2023
8JPC
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BU of 8jpc by Molmil
cryo-EM structure of NTSR1-GRK2-Galpha(q) complexes 2
Descriptor: 2-[{2-(1-fluorocyclopropyl)-4-[4-(2-methoxyphenyl)piperidin-1-yl]quinazolin-6-yl}(methyl)amino]ethan-1-ol, Beta-adrenergic receptor kinase 1, GUANOSINE-5'-DIPHOSPHATE, ...
Authors:Duan, J, Liu, H, Zhao, F, Yuan, Q, Ji, Y, Xu, H.E.
Deposit date:2023-06-11
Release date:2023-08-09
Last modified:2023-08-30
Method:ELECTRON MICROSCOPY (3.07 Å)
Cite:GPCR activation and GRK2 assembly by a biased intracellular agonist.
Nature, 620, 2023
8JPB
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BU of 8jpb by Molmil
cryo-EM structure of NTSR1-GRK2-Galpha(q) complexes 1
Descriptor: 2-[{2-(1-fluorocyclopropyl)-4-[4-(2-methoxyphenyl)piperidin-1-yl]quinazolin-6-yl}(methyl)amino]ethan-1-ol, Beta-adrenergic receptor kinase 1, GUANOSINE-5'-DIPHOSPHATE, ...
Authors:Duan, J, Liu, H, Zhao, F, Yuan, Q, Ji, Y, Xu, H.E.
Deposit date:2023-06-11
Release date:2023-08-09
Last modified:2023-08-30
Method:ELECTRON MICROSCOPY (3.07 Å)
Cite:GPCR activation and GRK2 assembly by a biased intracellular agonist.
Nature, 620, 2023
8JP9
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BU of 8jp9 by Molmil
Cryo-EM structure of the head region of full-length ERGIC-53 with MCFD2 (Substate D)
Descriptor: CALCIUM ION, Multiple coagulation factor deficiency protein 2, Protein ERGIC-53, ...
Authors:Watanabe, S, Inaba, K.
Deposit date:2023-06-10
Release date:2024-04-17
Method:ELECTRON MICROSCOPY (3.37 Å)
Cite:Structure of full-length ERGIC-53 in complex with MCFD2 for cargo transport.
Nat Commun, 15, 2024
8JP8
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BU of 8jp8 by Molmil
Cryo-EM structure of the head region of full-length ERGIC-53 with MCFD2 (Substate C)
Descriptor: CALCIUM ION, Multiple coagulation factor deficiency protein 2, Protein ERGIC-53, ...
Authors:Watanabe, S, Inaba, K.
Deposit date:2023-06-10
Release date:2024-04-17
Method:ELECTRON MICROSCOPY (3.39 Å)
Cite:Structure of full-length ERGIC-53 in complex with MCFD2 for cargo transport.
Nat Commun, 15, 2024
8JP7
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BU of 8jp7 by Molmil
Cryo-EM structure of the head region of full-length ERGIC-53 with MCFD2 (Substate B)
Descriptor: CALCIUM ION, Multiple coagulation factor deficiency protein 2, Protein ERGIC-53, ...
Authors:Watanabe, S, Inaba, K.
Deposit date:2023-06-10
Release date:2024-04-17
Method:ELECTRON MICROSCOPY (3.51 Å)
Cite:Structure of full-length ERGIC-53 in complex with MCFD2 for cargo transport.
Nat Commun, 15, 2024
8JP6
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BU of 8jp6 by Molmil
Cryo-EM structures of the head region of full-length ERGIC-53 with MCFD2 (Substate A)
Descriptor: CALCIUM ION, Multiple coagulation factor deficiency protein 2, Protein ERGIC-53, ...
Authors:Watanabe, S, Inaba, K.
Deposit date:2023-06-10
Release date:2024-04-17
Method:ELECTRON MICROSCOPY (3.29 Å)
Cite:Structure of full-length ERGIC-53 in complex with MCFD2 for cargo transport.
Nat Commun, 15, 2024
8JP5
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BU of 8jp5 by Molmil
Cryo-EM structures of the head region of full-length ERGIC-53 with MCFD2 (form B)
Descriptor: CALCIUM ION, Multiple coagulation factor deficiency protein 2, Protein ERGIC-53, ...
Authors:Watanabe, S, Inaba, K.
Deposit date:2023-06-10
Release date:2024-04-17
Method:ELECTRON MICROSCOPY (2.59 Å)
Cite:Structure of full-length ERGIC-53 in complex with MCFD2 for cargo transport.
Nat Commun, 15, 2024
8JP4
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BU of 8jp4 by Molmil
Cryo-EM structure of the head region of full-length ERGIC-53 with MCFD2 (form A)
Descriptor: CALCIUM ION, Multiple coagulation factor deficiency protein 2, Protein ERGIC-53, ...
Authors:Watanabe, S, Inaba, K.
Deposit date:2023-06-10
Release date:2024-04-17
Method:ELECTRON MICROSCOPY (2.53 Å)
Cite:Structure of full-length ERGIC-53 in complex with MCFD2 for cargo transport.
Nat Commun, 15, 2024
8JOW
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BU of 8jow by Molmil
Crystal structure of rabbit antibody with phosphorylated peptide bound
Descriptor: ARG-PRO-HIS-PHE-PRO-GLN-PHE-SEP-TYR-SER-ALA-SER, Antibody (scFv), CHLORIDE ION
Authors:Caaveiro, J.M.M, Kawade, R, Tsumoto, K.
Deposit date:2023-06-08
Release date:2024-06-12
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Origin of high binding affinity and selectivity of phosphorylated epitope-specific rabbit antibodies
To Be Published
8JOT
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BU of 8jot by Molmil
Crystal structure of CSF-1R kinase domain with sulfatinib
Descriptor: GLYCEROL, Macrophage colony-stimulating factor 1 receptor, N-(2-(dimethylamino)ethyl)-1-(3-((4-((2-methyl-1H-indol-5-yl)oxy)pyrimidin-2-yl)amino)phenyl)methanesulfonamide
Authors:Lin, Q.M, Chen, X.J, Chen, Y.H.
Deposit date:2023-06-08
Release date:2024-03-27
Method:X-RAY DIFFRACTION (1.69 Å)
Cite:Structural basis and selectivity of sulfatinib binding to FGFR and CSF-1R.
Commun Chem, 7, 2024
8JOP
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BU of 8jop by Molmil
Crystal structure of the SARS-CoV-2 main protease in complex with 11a
Descriptor: 3C-like proteinase nsp5, methyl (6~{R})-5-ethanoyl-7-oxidanylidene-6-[4-(trifluoromethyl)phenyl]-8,9,10,11-tetrahydro-6~{H}-benzo[b][1,4]benzodiazepine-2-carboxylate
Authors:Zeng, R, Liu, Y.Z, Wang, F.L, Yang, S.Y, Lei, J.
Deposit date:2023-06-08
Release date:2023-08-16
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Discovery of benzodiazepine derivatives as a new class of covalent inhibitors of SARS-CoV-2 main protease.
Bioorg.Med.Chem.Lett., 92, 2023
8JOK
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BU of 8jok by Molmil
Crystal structure of V30L mutated human transthyretin
Descriptor: MAGNESIUM ION, Transthyretin
Authors:Mizuguchi, M, Yamada, S, Obita, T.
Deposit date:2023-06-07
Release date:2024-04-17
Last modified:2024-05-01
Method:X-RAY DIFFRACTION (1.64 Å)
Cite:Trypsin-induced aggregation of transthyretin Valine 30 variants associated with hereditary amyloidosis.
Febs J., 291, 2024
8JOG
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BU of 8jog by Molmil
solution structure of Ras Binding Domein (RBD) in C-RAF with negative allosteric modulator.
Descriptor: RAF proto-oncogene serine/threonine-protein kinase
Authors:Makino, Y, Matsumoto, S, Yoshikawa, Y, Kawamura, T, Kumasaka, T, Shima, F.
Deposit date:2023-06-07
Release date:2024-06-12
Method:SOLUTION NMR
Cite:Small-molecule RAS/RAF-binding Inhibitors Allosterically Disrupt RAF Conformation and Exert Efficacy Against Broad-spectrum RAS-driven Cancers
To Be Published
8JOF
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BU of 8jof by Molmil
solution-structure of Ras Binding Domain (RBD) in C-RAF
Descriptor: RAF proto-oncogene serine/threonine-protein kinase
Authors:Makino, Y, Matsumoto, S, Yoshikawa, Y, Kawamura, T, Kumasaka, T, Shima, F.
Deposit date:2023-06-07
Release date:2024-06-12
Method:SOLUTION NMR
Cite:Small-molecule RAS/RAF-binding Inhibitors Allosterically Disrupt RAF Conformation and Exert Efficacy Against Broad-spectrum RAS-driven Cancers
To Be Published

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PDB entries from 2024-08-07

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