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4DUU
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BU of 4duu by Molmil
The X-ray Crystal Structure of Full-Length type I Human Plasminogen
Descriptor: Plasminogen
Authors:Law, R.H.P, Caradoc-Davies, T, Whisstock, J.C.
Deposit date:2012-02-22
Release date:2012-03-28
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (5.2 Å)
Cite:The X-ray crystal structure of full-length human plasminogen
Cell Rep, 1, 2012
4EVU
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BU of 4evu by Molmil
Crystal structure of C-terminal domain of putative periplasmic protein ydgH from S. enterica
Descriptor: CHLORIDE ION, Putative periplasmic protein ydgH, SULFATE ION
Authors:Michalska, K, Cui, H, Xu, X, Brown, R.N, Cort, J.R, Heffron, F, Nakayasu, E.S, Savchenko, A, Adkins, J.N, Joachimiak, A, Program for the Characterization of Secreted Effector Proteins (PCSEP), Midwest Center for Structural Genomics (MCSG)
Deposit date:2012-04-26
Release date:2012-05-30
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (1.45 Å)
Cite:Structural and Functional Characterization of DUF1471 Domains of Salmonella Proteins SrfN, YdgH/SssB, and YahO.
Plos One, 9, 2014
8DL9
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BU of 8dl9 by Molmil
Room temperature X-ray structure of SARS-CoV-2 main protease in complex with compound Z199538122
Descriptor: 1-{4-[(naphthalen-1-yl)methyl]piperazin-1-yl}ethan-1-one, 3C-like proteinase
Authors:Kovalevsky, A.Y, Coates, L, Kneller, D.W.
Deposit date:2022-07-07
Release date:2023-05-17
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:AI-Accelerated Design of Targeted Covalent Inhibitors for SARS-CoV-2.
J.Chem.Inf.Model., 63, 2023
8DLB
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BU of 8dlb by Molmil
Room temperature X-ray structure of SARS-CoV-2 main protease in complex with compound Z2799209083
Descriptor: 1-[(5S)-5-(3,4-dimethoxyphenyl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one, 3C-like proteinase
Authors:Kovalevsky, A.Y, Coates, L, Kneller, D.W.
Deposit date:2022-07-07
Release date:2023-05-17
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:AI-Accelerated Design of Targeted Covalent Inhibitors for SARS-CoV-2.
J.Chem.Inf.Model., 63, 2023
8DMD
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BU of 8dmd by Molmil
Room temperature X-ray structure of SARS-CoV-2 main protease in complex with compound ZZ4461624291
Descriptor: 1-[(3R)-4-[(3-chlorophenyl)methyl]-3-(2-methylpropyl)piperazin-1-yl]ethan-1-one, 3C-like proteinase
Authors:Kovalevsky, A, Coates, L, Kneller, D.W.
Deposit date:2022-07-08
Release date:2023-05-17
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (2 Å)
Cite:AI-Accelerated Design of Targeted Covalent Inhibitors for SARS-CoV-2.
J.Chem.Inf.Model., 63, 2023
4DUR
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BU of 4dur by Molmil
The X-ray Crystal Structure of Full-Length type II Human Plasminogen
Descriptor: ACETATE ION, BICARBONATE ION, CHLORIDE ION, ...
Authors:Law, R.H.P, Caradoc-Davies, T, Whisstock, J.C.
Deposit date:2012-02-22
Release date:2012-03-28
Last modified:2024-10-09
Method:X-RAY DIFFRACTION (2.45 Å)
Cite:The X-ray crystal structure of full-length human plasminogen
Cell Rep, 1, 2012
6VLT
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BU of 6vlt by Molmil
Crystal Structure of Human P450 2C9*2 Genetic Variant in Complex with Losartan
Descriptor: 5-CYCLOHEXYL-1-PENTYL-BETA-D-MALTOSIDE, Cytochrome P450 2C9, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Shah, M.B.
Deposit date:2020-01-25
Release date:2020-09-30
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (3.12 Å)
Cite:Structure of Cytochrome P450 2C9*2 in Complex with Losartan: Insights into the Effect of Genetic Polymorphism.
Mol.Pharmacol., 98, 2020
4E43
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BU of 4e43 by Molmil
HIV protease (PR) dimer with acetate in exo site and peptide in active site
Descriptor: ACETATE ION, BETA-MERCAPTOETHANOL, DIMETHYL SULFOXIDE, ...
Authors:Stout, C.D.
Deposit date:2012-03-11
Release date:2012-05-30
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.54 Å)
Cite:Fragment-based screen against HIV protease.
Chem.Biol.Drug Des., 75, 2010
8EUA
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BU of 8eua by Molmil
Structure of SARS-CoV2 PLpro bound to a covalent inhibitor
Descriptor: Papain-like protease nsp3, SULFATE ION, ZINC ION, ...
Authors:Mathews, I.I, Pokhrel, S, Wakatsuki, S.
Deposit date:2022-10-18
Release date:2023-04-05
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (3.1 Å)
Cite:Potent and selective covalent inhibition of the papain-like protease from SARS-CoV-2.
Nat Commun, 14, 2023
8YFD
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BU of 8yfd by Molmil
Cryo EM structure of human phosphate channel XPR1 at open state
Descriptor: Solute carrier family 53 member 1
Authors:Lu, Y, Yue, C, Zhang, L, Yao, D, Yu, Y, Cao, Y.
Deposit date:2024-02-24
Release date:2024-10-09
Method:ELECTRON MICROSCOPY (3.57 Å)
Cite:Structural basis for inositol pyrophosphate gating of the phosphate channel XPR1.
Science, 2024
8YFX
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BU of 8yfx by Molmil
Cryo EM structure of human phosphate channel XPR1 at inward-facing state
Descriptor: Solute carrier family 53 member 1
Authors:Lu, Y, Yue, C, Zhang, L, Yao, D, Yu, Y, Cao, Y.
Deposit date:2024-02-25
Release date:2024-10-09
Method:ELECTRON MICROSCOPY (3.56 Å)
Cite:Structural basis for inositol pyrophosphate gating of the phosphate channel XPR1.
Science, 2024
8HJB
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BU of 8hjb by Molmil
Crystal structure of Pseudomonas aeruginosa PvrA with coenzyme A
Descriptor: COENZYME A, TetR family transcriptional regulator
Authors:Liang, H, Bartlam, M.
Deposit date:2022-11-23
Release date:2023-02-08
Last modified:2024-05-29
Method:X-RAY DIFFRACTION (2.65 Å)
Cite:Regulatory and structural mechanisms of PvrA-mediated regulation of the PQS quorum-sensing system and PHA biosynthesis in Pseudomonas aeruginosa.
Nucleic Acids Res., 51, 2023
8YFW
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BU of 8yfw by Molmil
Cryo EM structure of human phosphate channel XPR1 at intermediate state
Descriptor: Solute carrier family 53 member 1
Authors:Lu, Y, Yue, C, Zhang, L, Yao, D, Yu, Y, Cao, Y.
Deposit date:2024-02-25
Release date:2024-10-09
Method:ELECTRON MICROSCOPY (3.65 Å)
Cite:Structural basis for inositol pyrophosphate gating of the phosphate channel XPR1.
Science, 2024
8YFU
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BU of 8yfu by Molmil
Cryo EM structure of human phosphate channel XPR1 at intermediate state
Descriptor: Solute carrier family 53 member 1
Authors:Lu, Y, Yue, C, Zhang, L, Yao, D, Yu, Y, Cao, Y.
Deposit date:2024-02-25
Release date:2024-10-09
Method:ELECTRON MICROSCOPY (4.59 Å)
Cite:Structural basis for inositol pyrophosphate gating of the phosphate channel XPR1.
Science, 2024
8YET
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BU of 8yet by Molmil
Cryo EM structure of human phosphate channel XPR1 in complex with IP6
Descriptor: INOSITOL HEXAKISPHOSPHATE, Solute carrier family 53 member 1
Authors:Lu, Y, Yue, C, Zhang, L, Yao, D, Yu, Y, Cao, Y.
Deposit date:2024-02-23
Release date:2024-10-09
Method:ELECTRON MICROSCOPY (4.16 Å)
Cite:Structural basis for inositol pyrophosphate gating of the phosphate channel XPR1.
Science, 2024
8YF4
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BU of 8yf4 by Molmil
Cryo EM structure of human phosphate channel XPR1 at open and inward-facing state
Descriptor: CHOLESTEROL HEMISUCCINATE, Solute carrier family 53 member 1
Authors:Lu, Y, Yue, C, Zhang, L, Yao, D, Yu, Y, Cao, Y.
Deposit date:2024-02-24
Release date:2024-10-09
Method:ELECTRON MICROSCOPY (3.41 Å)
Cite:Structural basis for inositol pyrophosphate gating of the phosphate channel XPR1.
Science, 2024
8YEX
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BU of 8yex by Molmil
Cryo EM structure of human phosphate channel XPR1 at apo state
Descriptor: Solute carrier family 53 member 1
Authors:Lu, Y, Yue, C, Zhang, L, Yao, D, Yu, Y, Cao, Y.
Deposit date:2024-02-23
Release date:2024-10-09
Method:ELECTRON MICROSCOPY (3.68 Å)
Cite:Structural basis for inositol pyrophosphate gating of the phosphate channel XPR1.
Science, 2024
8HC0
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BU of 8hc0 by Molmil
Crystal structure of the extracellular domains of GPR110
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, Adhesion G-protein coupled receptor F1, alpha-D-mannopyranose-(1-3)-alpha-D-mannopyranose-(1-6)-[alpha-D-mannopyranose-(1-3)]alpha-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose
Authors:Wang, F.F, Song, G.J.
Deposit date:2022-11-01
Release date:2023-09-13
Last modified:2024-05-01
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Crystal Structure of the Extracellular Domains of GPR110.
J.Mol.Biol., 435, 2023
7X2M
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BU of 7x2m by Molmil
Crystal structure of nanobody 1-2C7 with SARS-CoV-2 RBD
Descriptor: 1-2C7, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-D-mannopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, Spike protein S1
Authors:Wang, X.Q, Zhang, L.Q, Ren, Y.F, Li, M.X.
Deposit date:2022-02-25
Release date:2022-12-14
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Broadly neutralizing and protective nanobodies against SARS-CoV-2 Omicron subvariants BA.1, BA.2, and BA.4/5 and diverse sarbecoviruses.
Nat Commun, 13, 2022
7X2L
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BU of 7x2l by Molmil
Crystal structure of nanobody 3-2A2-4 with SARS-CoV-2 RBD
Descriptor: Nanobody 3-2A2-4, Spike protein S1, beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose
Authors:Wang, X.Q, Zhang, L.Q, Ren, Y.F, Li, M.X.
Deposit date:2022-02-25
Release date:2022-12-07
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Broadly neutralizing and protective nanobodies against SARS-CoV-2 Omicron subvariants BA.1, BA.2, and BA.4/5 and diverse sarbecoviruses.
Nat Commun, 13, 2022
7X2J
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BU of 7x2j by Molmil
Crystal structure of nanobody Nb70 with SARS-CoV RBD
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, Nb70, Spike protein S1
Authors:Wang, X.Q, Zhang, L.Q, Ren, Y.F, Li, M.X.
Deposit date:2022-02-25
Release date:2022-12-21
Last modified:2023-06-28
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Broadly neutralizing and protective nanobodies against SARS-CoV-2 Omicron subvariants BA.1, BA.2, and BA.4/5 and diverse sarbecoviruses.
Nat Commun, 13, 2022
7X2K
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BU of 7x2k by Molmil
Crystal structure of nanobody Nb70 with antibody 1F11 fab and SARS-CoV-2 RBD
Descriptor: 1F11-H, 1F11-L, 2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:Wang, X.Q, Zhang, L.Q, Ren, Y.F, Li, M.X.
Deposit date:2022-02-25
Release date:2022-12-21
Last modified:2023-06-28
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Broadly neutralizing and protective nanobodies against SARS-CoV-2 Omicron subvariants BA.1, BA.2, and BA.4/5 and diverse sarbecoviruses.
Nat Commun, 13, 2022
7EPM
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BU of 7epm by Molmil
human LDHC complexed with NAD+ and ethylamino acetic acid
Descriptor: 2-(ethylamino)-2-oxidanylidene-ethanoic acid, L-lactate dehydrogenase C chain, NICOTINAMIDE-ADENINE-DINUCLEOTIDE, ...
Authors:Yu, Y, Chen, Q.
Deposit date:2021-04-27
Release date:2022-03-02
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (3 Å)
Cite:Identification of human LDHC4 as a potential target for anticancer drug discovery.
Acta Pharm Sin B, 12, 2022
5T0O
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BU of 5t0o by Molmil
Crystal Structure of a membrane protein
Descriptor: CmeB
Authors:Su, C.-C, Yu, E.W.
Deposit date:2016-08-16
Release date:2017-09-06
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (3.15 Å)
Cite:Structures and transport dynamics of a Campylobacter jejuni multidrug efflux pump.
Nat Commun, 8, 2017
5UDA
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BU of 5uda by Molmil
Crystal structure of CYP2B6 (Y226H/K262R) in complex with a monoterpene bornane
Descriptor: 5-CYCLOHEXYL-1-PENTYL-BETA-D-MALTOSIDE, CAMPHANE, Cytochrome P450 2B6, ...
Authors:Shah, M.B, Halpert, J.R.
Deposit date:2016-12-24
Release date:2017-04-12
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (1.93 Å)
Cite:Halogen-pi Interactions in the Cytochrome P450 Active Site: Structural Insights into Human CYP2B6 Substrate Selectivity.
ACS Chem. Biol., 12, 2017

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数据于2024-10-16公开中

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