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3KQ0
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BU of 3kq0 by Molmil
Crystal structure of human alpha1-acid glycoprotein
Descriptor: (2R)-2,3-dihydroxypropyl acetate, Alpha-1-acid glycoprotein 1, CHLORIDE ION
Authors:Schiefner, A, Schonfeld, D.L, Ravelli, R.B.G, Mueller, U, Skerra, A.
Deposit date:2009-11-17
Release date:2010-02-02
Last modified:2019-12-25
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:The 1.8-A crystal structure of alpha1-acid glycoprotein (Orosomucoid) solved by UV RIP reveals the broad drug-binding activity of this human plasma lipocalin.
J.Mol.Biol., 384, 2008
7KEV
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BU of 7kev by Molmil
PCSK9 in complex with a cyclic peptide LDLR disruptor
Descriptor: CALCIUM ION, Proprotein convertase subtilisin/kexin type 9, Proprotein convertase subtilisin/kexin type 9 Propeptide, ...
Authors:Spraggon, G, Chopra, R.
Deposit date:2020-10-12
Release date:2021-11-24
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Identification of a PCSK9-LDLR disruptor peptide with in vivo function.
Cell Chem Biol, 29, 2022
3L27
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BU of 3l27 by Molmil
Crystal structure of Zaire Ebola VP35 interferon inhibitory domain R312A mutant
Descriptor: CHLORIDE ION, GLYCEROL, PHOSPHATE ION, ...
Authors:Leung, D.W, Prins, K.C, Borek, D.M, Farahbakhsh, M, Tufariello, J.M, Ramanan, P, Nix, J.C, Helgeson, L.A, Otwinowski, Z, Honzatko, R.B, Basler, C.F, Amarasinghe, G.K.
Deposit date:2009-12-14
Release date:2010-01-26
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Structural basis for dsRNA recognition and interferon antagonism by Ebola VP35.
Nat.Struct.Mol.Biol., 17, 2010
3L26
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BU of 3l26 by Molmil
Crystal structure of Zaire Ebola VP35 interferon inhibitory domain bound to 8 bp dsRNA
Descriptor: CHLORIDE ION, MAGNESIUM ION, Polymerase cofactor VP35, ...
Authors:Leung, D.W, Prins, K.C, Borek, D.M, Farahbakhsh, M, Tufariello, J.M, Ramanan, P, Nix, J.C, Helgeson, L.A, Otwinowski, Z, Honzatko, R.B, Basler, C.F, Amarasinghe, G.K.
Deposit date:2009-12-14
Release date:2010-01-26
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Structural basis for dsRNA recognition and interferon antagonism by Ebola VP35.
Nat.Struct.Mol.Biol., 17, 2010
1QKP
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BU of 1qkp by Molmil
HIGH RESOLUTION X-RAY STRUCTURE OF AN EARLY INTERMEDIATE IN THE BACTERIORHODOPSIN PHOTOCYCLE
Descriptor: BACTERIORHODOPSIN, RETINAL
Authors:Edman, K, Nollert, P, Royant, A, Belrhali, H, Pebay-Peyroula, E, Hajdu, J, Neutze, R, Landau, E.M.
Deposit date:1999-07-30
Release date:1999-10-24
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:High-resolution X-ray structure of an early intermediate in the bacteriorhodopsin photocycle.
Nature, 401, 1999
3L9W
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BU of 3l9w by Molmil
KefC C-terminal domain in complex with KefF and GSH
Descriptor: ADENOSINE MONOPHOSPHATE, FLAVIN MONONUCLEOTIDE, GLUTATHIONE, ...
Authors:Roosild, T.P.
Deposit date:2010-01-05
Release date:2010-11-17
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Mechanism of ligand-gated potassium efflux in bacterial pathogens.
Proc.Natl.Acad.Sci.USA, 107, 2010
3LDY
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BU of 3ldy by Molmil
An extraordinary mechanism of DNA perturbation exhibited by the rare-cutting HNH restriction endonuclease PacI
Descriptor: CALCIUM ION, DNA (5'-D(*GP*AP*GP*GP*CP*TP*TP*A)-3'), DNA (5'-D(P*AP*TP*TP*AP*AP*GP*CP*CP*TP*C)-3'), ...
Authors:Shen, B.W, Heiter, D, Chan, S.-H, Xu, S.-Y, Wilson, G, Stoddard, B.L.
Deposit date:2010-01-13
Release date:2010-04-21
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (1.97 Å)
Cite:Unusual target site disruption by the rare-cutting HNH restriction endonuclease PacI.
Structure, 18, 2010
8ROL
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BU of 8rol by Molmil
Human cohesin SMC3-HD(EQ)/RAD21-C complex - ATP-Mg-bound conformation - Form 2
Descriptor: Double-strand-break repair protein rad21 homolog, MAGNESIUM ION, PHOSPHOTHIOPHOSPHORIC ACID-ADENYLATE ESTER, ...
Authors:Vitoria Gomes, M, Romier, C.
Deposit date:2024-01-11
Release date:2024-09-11
Last modified:2024-09-18
Method:X-RAY DIFFRACTION (3.11 Å)
Cite:The cohesin ATPase cycle is mediated by specific conformational dynamics and interface plasticity of SMC1A and SMC3 ATPase domains.
Cell Rep, 43, 2024
8ROE
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BU of 8roe by Molmil
Human cohesin SMC1A-HD(shortCC-EQ)/RAD21-C complex - ADP-bound conformation
Descriptor: 64-kDa C-terminal product, ADENOSINE-5'-DIPHOSPHATE, Structural maintenance of chromosomes protein 1A
Authors:Vitoria Gomes, M, Romier, C.
Deposit date:2024-01-11
Release date:2024-09-11
Last modified:2024-09-18
Method:X-RAY DIFFRACTION (1.36 Å)
Cite:The cohesin ATPase cycle is mediated by specific conformational dynamics and interface plasticity of SMC1A and SMC3 ATPase domains.
Cell Rep, 43, 2024
8ROK
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BU of 8rok by Molmil
Human cohesin SMC3-HD(EQ)/RAD21-C complex - ATP-Mg-bound conformation - Form 1
Descriptor: Double-strand-break repair protein rad21 homolog, MAGNESIUM ION, PHOSPHOTHIOPHOSPHORIC ACID-ADENYLATE ESTER, ...
Authors:Vitoria Gomes, M, Romier, C.
Deposit date:2024-01-11
Release date:2024-09-11
Last modified:2024-09-18
Method:X-RAY DIFFRACTION (2.25 Å)
Cite:The cohesin ATPase cycle is mediated by specific conformational dynamics and interface plasticity of SMC1A and SMC3 ATPase domains.
Cell Rep, 43, 2024
8ROH
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BU of 8roh by Molmil
Human cohesin SMC3-HD(EQ)/RAD21-C complex - Apo conformation
Descriptor: Double-strand-break repair protein rad21 homolog, GLYCEROL, SULFATE ION, ...
Authors:Vitoria Gomes, M, Romier, C.
Deposit date:2024-01-11
Release date:2024-09-11
Last modified:2024-09-18
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:The cohesin ATPase cycle is mediated by specific conformational dynamics and interface plasticity of SMC1A and SMC3 ATPase domains.
Cell Rep, 43, 2024
8ROF
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BU of 8rof by Molmil
Human cohesin SMC1A-HD(shortCC-EQ)/RAD21-C complex - ADP-Mg-bound conformation
Descriptor: 64-kDa C-terminal product, ADENOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, ...
Authors:Vitoria Gomes, M, Romier, C.
Deposit date:2024-01-11
Release date:2024-09-11
Last modified:2024-09-18
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:The cohesin ATPase cycle is mediated by specific conformational dynamics and interface plasticity of SMC1A and SMC3 ATPase domains.
Cell Rep, 43, 2024
8ROC
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BU of 8roc by Molmil
Human cohesin SMC1A-HD(shortCC-EQ)/RAD21-C complex - Apo closed P-loop conformation
Descriptor: 64-kDa C-terminal product, Structural maintenance of chromosomes protein 1A
Authors:Vitoria Gomes, M, Romier, C.
Deposit date:2024-01-11
Release date:2024-09-11
Last modified:2024-09-18
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:The cohesin ATPase cycle is mediated by specific conformational dynamics and interface plasticity of SMC1A and SMC3 ATPase domains.
Cell Rep, 43, 2024
8ROJ
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BU of 8roj by Molmil
Human cohesin SMC3-HD/RAD21-C complex - ADP-Mg-bound conformation
Descriptor: ADENOSINE-5'-DIPHOSPHATE, Double-strand-break repair protein rad21 homolog, MAGNESIUM ION, ...
Authors:Vitoria Gomes, M, Romier, C.
Deposit date:2024-01-11
Release date:2024-09-11
Last modified:2024-09-18
Method:X-RAY DIFFRACTION (3 Å)
Cite:The cohesin ATPase cycle is mediated by specific conformational dynamics and interface plasticity of SMC1A and SMC3 ATPase domains.
Cell Rep, 43, 2024
6WN0
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BU of 6wn0 by Molmil
The structure of a CoA-dependent acyl-homoserine lactone synthase, RpaI, with the adduct of SAH and p-coumaroyl CoA
Descriptor: (2S)-4-({[(2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl}sulfanyl)-2-{[(2E)-3-(cis-4-hydroxycyclohexa-2,5-dien-1-yl)prop-2-enoyl]amino}butanoic acid, 4-coumaroyl-homoserine lactone synthase, COENZYME A
Authors:Dong, S.-H, Nair, S.K.
Deposit date:2020-04-22
Release date:2020-05-13
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:Structure-Guided Biochemical Analysis of Quorum Signal Synthase Specificities.
Acs Chem.Biol., 15, 2020
8ROD
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BU of 8rod by Molmil
Human cohesin SMC1A-HD(shortCC-EQ)/RAD21-C complex - Open/closed P-loop conformation
Descriptor: 64-kDa C-terminal product, SULFATE ION, Structural maintenance of chromosomes protein 1A
Authors:Vitoria Gomes, M, Romier, C.
Deposit date:2024-01-11
Release date:2024-09-11
Last modified:2024-09-18
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:The cohesin ATPase cycle is mediated by specific conformational dynamics and interface plasticity of SMC1A and SMC3 ATPase domains.
Cell Rep, 43, 2024
8ROG
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BU of 8rog by Molmil
Human cohesin SMC1A-HD(shortCC-EQ)/RAD21-C complex - ATPgS-Mg-bound conformation
Descriptor: 64-kDa C-terminal product, MAGNESIUM ION, PHOSPHOTHIOPHOSPHORIC ACID-ADENYLATE ESTER, ...
Authors:Vitoria Gomes, M, Romier, C.
Deposit date:2024-01-11
Release date:2024-09-11
Last modified:2024-09-18
Method:X-RAY DIFFRACTION (1.94 Å)
Cite:The cohesin ATPase cycle is mediated by specific conformational dynamics and interface plasticity of SMC1A and SMC3 ATPase domains.
Cell Rep, 43, 2024
8ROI
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BU of 8roi by Molmil
Human cohesin SMC3-HD(EQ)/RAD21-C complex - ADP-bound conformation
Descriptor: ADENOSINE-5'-DIPHOSPHATE, Double-strand-break repair protein rad21 homolog, Structural maintenance of chromosomes protein 3
Authors:Vitoria Gomes, M, Romier, C.
Deposit date:2024-01-11
Release date:2024-09-11
Last modified:2024-09-18
Method:X-RAY DIFFRACTION (2.45 Å)
Cite:The cohesin ATPase cycle is mediated by specific conformational dynamics and interface plasticity of SMC1A and SMC3 ATPase domains.
Cell Rep, 43, 2024
1AMC
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BU of 1amc by Molmil
SOLUTION STRUCTURE OF RESIDUES 1-28 OF THE AMYLOID BETA-PEPTIDE
Descriptor: AMYLOID BETA-PEPTIDE
Authors:Talafous, J, Marcinowski, K.J, Klopman, G, Zagorski, M.G.
Deposit date:1994-11-14
Release date:1995-01-26
Last modified:2024-05-22
Method:SOLUTION NMR
Cite:Solution structure of residues 1-28 of the amyloid beta-peptide.
Biochemistry, 33, 1994
3LK9
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BU of 3lk9 by Molmil
DNA polymerase beta with a gapped DNA substrate and dTMP(CF2)P(CF2)P
Descriptor: 5'-O-[(R)-{[(R)-[difluoro(phosphono)methyl](hydroxy)phosphoryl](difluoro)methyl}(hydroxy)phosphoryl]thymidine, CHLORIDE ION, DNA (5'-D(*CP*CP*GP*AP*CP*AP*GP*CP*GP*CP*AP*TP*CP*AP*GP*C)-3'), ...
Authors:Zibinsky, M, Surya Prakash, G.K, Upton, T.G, Kashemirov, B.A, McKenna, C.E, Oertell, K, Goodman, M.F, Batra, V.K, Pedersen, L.C, Beard, W.A, Wilson, S.H.
Deposit date:2010-01-27
Release date:2011-01-12
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Synthesis and biological evaluation of fluorinated deoxynucleotide analogs based on bis-(difluoromethylene)triphosphoric acid.
Proc.Natl.Acad.Sci.USA, 107, 2010
1EQW
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BU of 1eqw by Molmil
CRYSTAL STRUCTURE OF SALMONELLA TYPHIMURIUM CU,ZN SUPEROXIDE DISMUTASE
Descriptor: COPPER (II) ION, CU,ZN SUPEROXIDE DISMUTASE, ZINC ION
Authors:Pesce, A, Battistoni, A, Stroppolo, M.E, Polizio, F, Nardini, M, Kroll, J.S, Langford, P.R, O'Neill, P, Sette, M, Desideri, A, Bolognesi, M.
Deposit date:2000-04-06
Release date:2000-09-08
Last modified:2017-10-11
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Functional and crystallographic characterization of Salmonella typhimurium Cu,Zn superoxide dismutase coded by the sodCI virulence gene.
J.Mol.Biol., 302, 2000
7LVP
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BU of 7lvp by Molmil
Cryptococcus neoformans AIR synthetase
Descriptor: 1,2-ETHANEDIOL, AIR synthase, GLYCINE, ...
Authors:Chua, S.M.H, Luo, Z, Lim, B.Y.J, Kobe, B, Fraser, J.A.
Deposit date:2021-02-26
Release date:2021-08-25
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.24 Å)
Cite:Structural features of Cryptococcus neoformans bifunctional GAR/AIR synthetase may present novel antifungal drug targets.
J.Biol.Chem., 297, 2021
7SWQ
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BU of 7swq by Molmil
Cryo-EM structure of Arabidopsis Ago10-guide-target RNA complex in a bent duplex conformation
Descriptor: MAGNESIUM ION, Protein argonaute 10, RNA (5'-R(P*CP*CP*AP*UP*UP*GP*UP*CP*AP*CP*AP*CP*UP*CP*CP*AP*AP*A)-3'), ...
Authors:Xiao, Y, MacRae, I.J.
Deposit date:2021-11-21
Release date:2022-11-23
Last modified:2024-06-05
Method:ELECTRON MICROSCOPY (3.79 Å)
Cite:Structural basis for RNA slicing by a plant Argonaute.
Nat.Struct.Mol.Biol., 30, 2023
7LVO
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BU of 7lvo by Molmil
Cryptococcus neoformans GAR synthetase
Descriptor: 1,2-ETHANEDIOL, phosphoribosyl-glycinamide (GAR) synthetase
Authors:Chua, S.M.H, Luo, Z, Lim, B.Y.J, Kobe, B, Fraser, J.A.
Deposit date:2021-02-26
Release date:2021-08-25
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2 Å)
Cite:Structural features of Cryptococcus neoformans bifunctional GAR/AIR synthetase may present novel antifungal drug targets.
J.Biol.Chem., 297, 2021
3LU8
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BU of 3lu8 by Molmil
Human serum albumin in complex with compound 3
Descriptor: N-[5-(5-{[(2,4-dimethyl-1,3-thiazol-5-yl)sulfonyl]amino}-6-fluoropyridin-3-yl)-4-methyl-1,3-thiazol-2-yl]acetamide, Serum albumin
Authors:Buttar, D, Colclough, N, Gerhardt, S, MacFaul, P.A, Phillips, S.D, Plowright, A, Whittamore, P, Tam, K, Maskos, K, Steinbacher, S, Steuber, H.
Deposit date:2010-02-17
Release date:2010-10-27
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:A combined spectroscopic and crystallographic approach to probing drug-human serum albumin interactions
Bioorg.Med.Chem., 18, 2010

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數據於2024-09-18公開中

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