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8XXB
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BU of 8xxb by Molmil
Crystal Structure of a triple-mutant (A69F/M124P/R127G) of halohydrin dehalogenase HheD8 complexed with chloride
Descriptor: CHLORIDE ION, Short-chain dehydrogenase/reductase SDR
Authors:Wan, N.W.
Deposit date:2024-01-18
Release date:2024-01-31
Last modified:2025-02-26
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Biocatalytic enantioselective formation and ring-opening of oxetanes.
Nat Commun, 16, 2025
8PT0
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BU of 8pt0 by Molmil
ERK2 covelently bound to RU75 cyclohexenone based inhibitor
Descriptor: GLYCEROL, Mitogen-activated protein kinase 1, PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER, ...
Authors:Sok, P, Poti, A, Remenyi, A, Gogl, G.
Deposit date:2023-07-13
Release date:2024-07-24
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:Targeting a key protein-protein interaction surface on mitogen-activated protein kinases by a precision-guided warhead scaffold.
Nat Commun, 15, 2024
8XPE
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BU of 8xpe by Molmil
Crystal structure of Tris-bound TsaBgl (DATA III)
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, SODIUM ION, beta-glucosidase
Authors:Nam, K.H.
Deposit date:2024-01-03
Release date:2024-01-31
Last modified:2024-04-17
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Structural analysis of Tris binding in beta-glucosidases.
Biochem.Biophys.Res.Commun., 700, 2024
8PV0
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BU of 8pv0 by Molmil
Crystal structure of tropomyosin (Cdc8) cables, Conformers 2 and 3
Descriptor: Tropomyosin
Authors:Reinke, P.Y.A, Zahn, M, Fedorov, R, Manstein, D.J.
Deposit date:2023-07-17
Release date:2024-07-24
Last modified:2025-04-02
Method:X-RAY DIFFRACTION (2.43 Å)
Cite:Crystal structures of cables formed by the acetylated and unacetylated forms of the Schizosaccharomyces pombe tropomyosin ortholog Tpm Cdc8.
J.Biol.Chem., 300, 2024
8XX9
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BU of 8xx9 by Molmil
Rhodothermus marinus alpha-amylase RmGH13_47A CBM48-A-B-C domains
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, CALCIUM ION, ...
Authors:Tonozuka, T.
Deposit date:2024-01-18
Release date:2024-02-07
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Structural basis for the recognition of alpha-1,6-branched alpha-glucan by GH13_47 alpha-amylase from Rhodothermus marinus.
Proteins, 92, 2024
6CZI
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BU of 6czi by Molmil
Structure of a redesigned beta barrel, mFAP1, bound to DFHBI
Descriptor: (5Z)-5-(3,5-difluoro-4-hydroxybenzylidene)-2,3-dimethyl-3,5-dihydro-4H-imidazol-4-one, mFAP1
Authors:Doyle, L.A, Stoddard, B.L.
Deposit date:2018-04-09
Release date:2018-09-19
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:De novo design of a fluorescence-activating beta-barrel.
Nature, 561, 2018
7SLR
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BU of 7slr by Molmil
HIV Reverse Transcriptase with compound Pyr01
Descriptor: 5-(difluoromethyl)-3-({1-[(5-fluoro-2-oxo-1,2-dihydropyridin-3-yl)methyl]-6-oxo-4-(1,1,2,2-tetrafluoroethyl)-1,6-dihydropyrimidin-5-yl}oxy)-2-methylbenzonitrile, Reverse transcriptase/ribonuclease H
Authors:Klein, D.J, Zebisch, M, Gu, M.
Deposit date:2021-10-24
Release date:2022-11-23
Last modified:2024-05-22
Method:X-RAY DIFFRACTION (2.179 Å)
Cite:Potent targeted activator of cell kill molecules eliminate cells expressing HIV-1.
Sci Transl Med, 15, 2023
8XU5
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BU of 8xu5 by Molmil
The Crystal Structure of RORgT from Biortus.
Descriptor: Nuclear receptor ROR-gamma
Authors:Wang, F, Cheng, W, Yuan, Z, Qi, J, Wu, B.
Deposit date:2024-01-12
Release date:2024-01-24
Method:X-RAY DIFFRACTION (3.5 Å)
Cite:The Crystal Structure of RORgT from Biortus.
To Be Published
8PKR
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BU of 8pkr by Molmil
Crystal structure of PknD-345, a repeat fragment from the M. tuberculosis PknD beta-propeller
Descriptor: GLYCEROL, non-specific serine/threonine protein kinase
Authors:Wouters, S.M.L.
Deposit date:2023-06-27
Release date:2024-07-10
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:Computational design of the SAKe scaffold proteins
To Be Published
8XPC
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BU of 8xpc by Molmil
Crystal structure of Tris-bound TsaBgl (DATA I)
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, SODIUM ION, beta-glucosidase
Authors:Nam, K.H.
Deposit date:2024-01-03
Release date:2024-01-31
Last modified:2024-04-17
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Structural analysis of Tris binding in beta-glucosidases.
Biochem.Biophys.Res.Commun., 700, 2024
7SFN
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BU of 7sfn by Molmil
Crystal structure of OlmO, a spirocyclase involved in the biosynthesis of oligomycin
Descriptor: D-MALATE, OlmO - oligomycin spirocyclase
Authors:Bilyk, O, Leadlay, P.F, Dias, M.V.B.
Deposit date:2021-10-04
Release date:2022-08-17
Last modified:2024-05-22
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Enzyme-Catalyzed Spiroacetal Formation in Polyketide Antibiotic Biosynthesis.
J.Am.Chem.Soc., 144, 2022
8XPD
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BU of 8xpd by Molmil
Crystal structure of Tris-bound TsaBgl (DATA II)
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, SODIUM ION, beta-glucosidase
Authors:Nam, K.H.
Deposit date:2024-01-03
Release date:2024-01-31
Last modified:2024-04-17
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Structural analysis of Tris binding in beta-glucosidases.
Biochem.Biophys.Res.Commun., 700, 2024
8Y0X
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BU of 8y0x by Molmil
Dormant ribosome with SERBP1
Descriptor: 18S rRNA, 28S rRNA, 40S ribosomal protein S10, ...
Authors:Du, M, Zeng, F.
Deposit date:2024-01-23
Release date:2024-02-07
Last modified:2024-08-21
Method:ELECTRON MICROSCOPY (3.3 Å)
Cite:Implication of Stm1 in the protection of eIF5A, eEF2 and tRNA through dormant ribosomes.
Front Mol Biosci, 11, 2024
7SEI
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BU of 7sei by Molmil
Glucose-6-phosphate 1-dehydrogenase (K403Q)
Descriptor: Glucose-6-phosphate 1-dehydrogenase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
Authors:Mathews, I.I, Garcia, A.A, Wakatsuki, S, Mochly-Rosen, D.
Deposit date:2021-09-30
Release date:2022-08-17
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (3.65 Å)
Cite:Stabilization of glucose-6-phosphate dehydrogenase oligomers enhances catalytic activity and stability of clinical variants.
J.Biol.Chem., 298, 2022
8Y4Z
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BU of 8y4z by Molmil
Monomeric HERC5 HECT c-lobe structure in solution
Descriptor: E3 ISG15--protein ligase HERC5
Authors:Dag, C, Lambert, M, Kahraman, K, Lohn, F, Lee, W, Gocenler, O, Guntert, P, Dotsch, V.
Deposit date:2024-01-31
Release date:2024-02-14
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:Monomeric HERC5 HECT c-lobe structure in solution
To Be Published
8YA5
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BU of 8ya5 by Molmil
Mpro from SARS-CoV-2
Descriptor: 3C-like proteinase
Authors:Zhang, C.Y, Xu, Q, Wang, W.W, Zhou, H, Wang, Q.S.
Deposit date:2024-02-07
Release date:2024-02-28
Method:X-RAY DIFFRACTION (2.72 Å)
Cite:Crystallographic data collection using a multilayer monochromator on an undulator beamline at SSRF
To Be Published
6CKR
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BU of 6ckr by Molmil
Crystal Structure of BRD4 with QC4956
Descriptor: Bromodomain-containing protein 4, N-{3-[2-methyl-6-(1-methyl-1H-pyrazol-4-yl)-1-oxo-1,2-dihydroisoquinolin-4-yl]phenyl}methanesulfonamide
Authors:Hosfield, D.J.
Deposit date:2018-02-28
Release date:2018-05-02
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (1.62 Å)
Cite:Design, synthesis and biological evaluation of novel 4-phenylisoquinolinone BET bromodomain inhibitors.
Bioorg. Med. Chem. Lett., 28, 2018
8YA1
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BU of 8ya1 by Molmil
HEN EGG WHITE LYSOZYME
Descriptor: Lysozyme C
Authors:Zhang, C.Y, Xu, Q, Wang, W.W, Zhou, H.
Deposit date:2024-02-07
Release date:2024-02-28
Last modified:2024-11-13
Method:X-RAY DIFFRACTION (1.57 Å)
Cite:Crystallographic data collection using a multilayer monochromator on an undulator beamline at SSRF
To Be Published
8YBG
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BU of 8ybg by Molmil
Crystal structure of lysozyme by serial synchrotron crystallography
Descriptor: CHLORIDE ION, Lysozyme C, SODIUM ION
Authors:Nam, K.H.
Deposit date:2024-02-14
Release date:2024-02-28
Last modified:2024-11-13
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Crystal structure of lysozyme by serial synchrotron crystallography
To Be Published
6CL2
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BU of 6cl2 by Molmil
Caspase-7 in complex with Ac-ATS009-KE
Descriptor: ACE-1MH-ASP-PF5-PHE-1U8, Caspase-7 subunit p11, Caspase-7 subunit p20
Authors:Solania, A.T, Gonzalez-Paez, G.E, Wolan, D.W.
Deposit date:2018-03-01
Release date:2019-03-06
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (2.35 Å)
Cite:Selective and Rapid Cell-Permeable Inhibitor of Human Caspase-3.
Acs Chem.Biol., 14, 2019
8Y4U
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BU of 8y4u by Molmil
Crystal structure of a His1 from oryza sativa
Descriptor: FE (III) ION, Fe(II)/2-oxoglutarate-dependent oxygenase
Authors:Wang, N, Ma, J.M, Shibing, H, Beibei, Y, He, Z, Dandan, L.
Deposit date:2024-01-30
Release date:2024-02-28
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Crystal structure of HPPD inhibitor sensitive protein from Oryza sativa.
Biochem.Biophys.Res.Commun., 704, 2024
8YA4
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BU of 8ya4 by Molmil
Crystal structure of a lysozyme form hen egg white
Descriptor: Lysozyme C
Authors:Zhang, C.Y, Xu, Q, Wang, W.W, Zhou, H.
Deposit date:2024-02-07
Release date:2024-02-28
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Crystallographic data collection using a multilayer monochromator on an undulator beamline at SSRF
To Be Published
8PKB
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BU of 8pkb by Molmil
Staphylococcus aureus endonuclease IV with bound phosphate
Descriptor: CHLORIDE ION, FE (III) ION, PHOSPHATE ION, ...
Authors:Saper, M, Kirillov, S, Rouvinski, A.
Deposit date:2023-06-26
Release date:2024-07-10
Last modified:2025-01-15
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Octahedral Iron in Catalytic Sites of Endonuclease IV from Staphylococcus aureus and Escherichia coli .
Biochemistry, 64, 2025
6D12
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BU of 6d12 by Molmil
Crystal structure of C-terminal xRRM domain of human Larp7 bound to 7SK stem-loop 4 RNA
Descriptor: La-related protein 7, human 7SK RNA stem-loop 4
Authors:Eichhorn, C.D, Cascio, D, Sawaya, M.R, Feigon, J.
Deposit date:2018-04-11
Release date:2018-06-27
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (2.205 Å)
Cite:Structural basis for recognition of human 7SK long noncoding RNA by the La-related protein Larp7.
Proc. Natl. Acad. Sci. U.S.A., 115, 2018
8YBH
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BU of 8ybh by Molmil
Crystal structure of lysozyme by macromolecular crystallography
Descriptor: CHLORIDE ION, Lysozyme C, SODIUM ION
Authors:Nam, K.H.
Deposit date:2024-02-14
Release date:2024-02-28
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Crystal structure of lysozyme by macromolecular crystallography
To Be Published

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数据于2025-11-26公开中

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