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1ELQ
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BU of 1elq by Molmil
CRYSTAL STRUCTURE OF THE CYSTINE C-S LYASE C-DES
分子名称: L-CYSTEINE/L-CYSTINE C-S LYASE, POTASSIUM ION, PYRIDOXAL-5'-PHOSPHATE
著者Clausen, T, Kaiser, J.T, Steegborn, C, Huber, R, Kessler, D.
登録日2000-03-14
公開日2000-04-19
最終更新日2021-11-03
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Crystal structure of the cystine C-S lyase from Synechocystis: stabilization of cysteine persulfide for FeS cluster biosynthesis.
Proc.Natl.Acad.Sci.USA, 97, 2000
8SWO
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BU of 8swo by Molmil
GpppA dinucleotide ligand binding to RNA UC template
分子名称: GUANOSINE-P3-ADENOSINE-5',5'-TRIPHOSPHATE, MAGNESIUM ION, RNA (5'-R(*(TLN)P*(LCC)P*(LCC)P*(LCG)P*AP*CP*UP*UP*AP*AP*GP*UP*CP*G*(GA3))-3')
著者Zhang, W, Dantsu, Y.
登録日2023-05-19
公開日2023-05-31
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (1.64 Å)
主引用文献Insight into the structures of unusual base pairs in RNA complexes containing a primer/template/adenosine ligand.
Rsc Chem Biol, 4, 2023
7SFB
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BU of 7sfb by Molmil
SARS-CoV-2 Main Protease (Mpro) in Complex with ML101
分子名称: 3C-like proteinase, DI(HYDROXYETHYL)ETHER, TRIETHYLENE GLYCOL, ...
著者Westberg, M, Fernandez, D, Lin, M.Z.
登録日2021-10-03
公開日2022-10-05
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Rational design of a new class of protease inhibitors for the potential treatment of coronavirus diseases
To Be Published
6DZ3
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BU of 6dz3 by Molmil
Crystal structure of human 5'-deoxy-5'-methylthioadenosine phosphorylase in complex with (3R,4S)-1-((4-amino-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl)-4-(((3-(1-butyl-1H-1,2,3-triazol-4-yl)propyl)thio)methyl)pyrrolidin-3-ol
分子名称: (3R,4S)-1-[(4-amino-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]-4-({[3-(1-butyl-1H-1,2,3-triazol-4-yl)propyl]sulfanyl}methyl)pyrrolidin-3-ol, 1,2-ETHANEDIOL, ACETIC ACID, ...
著者Harijan, R.K, Ducati, R.G, Bonanno, J.B, Almo, S.C, Schramm, V.L.
登録日2018-07-02
公開日2019-03-20
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (1.91 Å)
主引用文献Selective Inhibitors of Helicobacter pylori Methylthioadenosine Nucleosidase and Human Methylthioadenosine Phosphorylase.
J. Med. Chem., 62, 2019
3CC1
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BU of 3cc1 by Molmil
CRYSTAL STRUCTURE OF A PUTATIVE ALPHA-N-ACETYLGALACTOSAMINIDASE (BH1870) FROM BACILLUS HALODURANS C-125 AT 2.00 A RESOLUTION
分子名称: 3,6,9,12,15,18-HEXAOXAICOSANE-1,20-DIOL, DI(HYDROXYETHYL)ETHER, GLYCEROL, ...
著者Joint Center for Structural Genomics (JCSG)
登録日2008-02-23
公開日2008-03-18
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Crystal structure of putative alpha-N-acetylgalactosaminidase (NP_242736.1) from Bacillus halodurans at 2.00 A resolution
To be published
7SFI
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BU of 7sfi by Molmil
SARS-CoV-2 Main Protease (Mpro) in Complex with ML104
分子名称: (1R,2S,5S)-N-{(2S,3R)-4-amino-3-hydroxy-4-oxo-1-[(3S)-2-oxopyrrolidin-3-yl]butan-2-yl}-6,6-dimethyl-3-[N-(2,4,6-trifluorophenyl)glycyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide, 3C-like proteinase, CALCIUM ION, ...
著者Westberg, M, Fernandez, D, Lin, M.Z.
登録日2021-10-03
公開日2022-10-05
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献Rational design of a new class of protease inhibitors for the potential treatment of coronavirus diseases
To Be Published
3CCO
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BU of 3cco by Molmil
Structural adaptation and conservation in quadruplex-drug recognition
分子名称: 2,7-bis[3-(dimethylamino)propyl]-4,9-bis[(3-hydroxypropyl)amino]benzo[lmn][3,8]phenanthroline-1,3,6,8(2H,7H)-tetrone, DNA (5'-D(*DTP*DAP*DGP*DGP*DGP*DTP*DTP*DAP*DGP*DGP*DGP*DT)-3'), POTASSIUM ION, ...
著者Parkinson, G.N, Neidle, S.
登録日2008-02-26
公開日2008-09-23
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Topology conservation and loop flexibility in quadruplex-drug recognition: crystal structures of inter- and intramolecular telomeric DNA quadruplex-drug complexes
J.Mol.Biol., 381, 2008
3CDZ
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BU of 3cdz by Molmil
Crystal structure of human factor VIII
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, CALCIUM ION, ...
著者Ngo, J.C, Huang, M, Roth, D.A, Furie, B.C, Furie, B.
登録日2008-02-27
公開日2008-04-01
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (3.98 Å)
主引用文献Crystal structure of human factor VIII: implications for the formation of the factor IXa-factor VIIIa complex.
Structure, 16, 2008
3CE1
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BU of 3ce1 by Molmil
Crystal Structure of the Cu/Zn Superoxide Dismutase from Cryptococcus liquefaciens Strain N6
分子名称: ACETATE ION, COPPER (II) ION, Superoxide dismutase [Cu-Zn], ...
著者Teh, A.H, Kanamasa, S, Kajiwara, S, Kumasaka, T.
登録日2008-02-27
公開日2008-08-26
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (1.2 Å)
主引用文献Structure of Cu/Zn superoxide dismutase from the heavy-metal-tolerant yeast Cryptococcus liquefaciens strain N6.
Biochem.Biophys.Res.Commun., 374, 2008
3CDA
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BU of 3cda by Molmil
Thermodynamic and structure guided design of statin hmg-coa reductase inhibitors
分子名称: (3R,5R)-7-{3-(4-fluorophenyl)-1-(1-methylethyl)-4-phenyl-5-[(4-sulfamoylphenyl)carbamoyl]-1H-pyrrol-2-yl}-3,5-dihydroxyheptanoic acid, 3-hydroxy-3-methylglutaryl-coenzyme A reductase
著者Pavlovsky, A, Sarver, R.W, Harris, M.S, Finzel, B.C.
登録日2008-02-26
公開日2008-06-17
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (2.07 Å)
主引用文献Thermodynamic and structure guided design of statin based inhibitors of 3-hydroxy-3-methylglutaryl coenzyme a reductase.
J.Med.Chem., 51, 2008
6IVQ
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BU of 6ivq by Molmil
Crystal structure of a membrane protein S19A
分子名称: 1,2-ETHANEDIOL, ACETIC ACID, CHLORIDE ION, ...
著者Kittredge, A, Fukuda, F, Zhang, Y, Yang, T.
登録日2018-12-04
公開日2019-11-06
最終更新日2024-05-29
実験手法X-RAY DIFFRACTION (2.65 Å)
主引用文献Dual Ca2+-dependent gates in human Bestrophin1 underlie disease-causing mechanisms of gain-of-function mutations.
Commun Biol, 2, 2019
3CDX
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BU of 3cdx by Molmil
Crystal structure of succinylglutamatedesuccinylase/aspartoacylase from Rhodobacter sphaeroides
分子名称: CALCIUM ION, Succinylglutamatedesuccinylase/aspartoacylase
著者Bonanno, J.B, Rutter, M, Bain, K.T, Iizuka, M, Patterson, K, Smith, D, Wasserman, S, Sauder, J.M, Burley, S.K, Almo, S.C, New York SGX Research Center for Structural Genomics (NYSGXRC)
登録日2008-02-27
公開日2008-03-11
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Crystal structure of succinylglutamatedesuccinylase/aspartoacylase from Rhodobacter sphaeroides.
To be Published
7SET
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BU of 7set by Molmil
SARS-CoV-2 Main Protease (Mpro) in Complex with ML1000
分子名称: (1R,2S,5S)-N-{(2S,3R)-4-amino-3-hydroxy-4-oxo-1-[(3S)-2-oxopyrrolidin-3-yl]butan-2-yl}-3-[N-(tert-butylcarbamoyl)-3-methyl-L-valyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide, 3C-like proteinase, CHLORIDE ION
著者Westberg, M, Fernandez, D, Lin, M.Z.
登録日2021-10-01
公開日2022-10-05
最終更新日2024-04-17
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献An orally bioavailable SARS-CoV-2 main protease inhibitor exhibits improved affinity and reduced sensitivity to mutations.
Sci Transl Med, 16, 2024
7S2A
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BU of 7s2a by Molmil
Crystal structure of hen egg white lysozyme
分子名称: Lysozyme C, SODIUM ION
著者Lima, L.M.T.R, Ramos, N.G, Ribeiro, F.S.
登録日2021-09-03
公開日2022-07-13
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献The reproducible normality of the crystallographic B-factor.
Anal.Biochem., 645, 2022
3CEJ
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BU of 3cej by Molmil
Human glycogen phosphorylase (tense state) in complex with the allosteric inhibitor AVE2865
分子名称: 1-{2-[3-(2-Chloro-4,5-difluoro-benzoyl)-ureido]-4-fluoro-phenyl}-piperidine-4-carboxylic acid, Glycogen phosphorylase, liver form, ...
著者Wendt, K.U, Dreyer, M.K, Anderka, O, Klabunde, T, Loenze, P, Defossa, E, Schmoll, D.
登録日2008-02-29
公開日2008-05-27
最終更新日2020-07-29
実験手法X-RAY DIFFRACTION (3.3 Å)
主引用文献Thermodynamic characterization of allosteric glycogen phosphorylase inhibitors.
Biochemistry, 47, 2008
7S2F
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BU of 7s2f by Molmil
Crystal structure of hen egg white lysozyme
分子名称: Lysozyme C, SODIUM ION
著者Lima, L.M.T.R, Ramos, N.G, Ribeiro, F.S.
登録日2021-09-03
公開日2022-07-13
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.58 Å)
主引用文献The reproducible normality of the crystallographic B-factor.
Anal.Biochem., 645, 2022
5KBE
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BU of 5kbe by Molmil
CRYSTAL STRUCTURE OF THE AROMATIC SENSOR DOMAIN OF MOPR IN COMPLEX WITH PHENOL
分子名称: MopR, PHENOL, ZINC ION
著者Ray, S, Anand, R, Panjikar, S.
登録日2016-06-03
公開日2016-07-13
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Structural Basis of Selective Aromatic Pollutant Sensing by the Effector Binding Domain of MopR, an NtrC Family Transcriptional Regulator.
Acs Chem.Biol., 11, 2016
3CFF
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BU of 3cff by Molmil
Photoswitchable red fluorescent protein psRFP, on-state
分子名称: GFP-like photoswitchable fluorescent protein
著者Kachalova, G.S, Gundel, S, Bartunik, H.D, Wiedenmann, J.
登録日2008-03-03
公開日2009-03-10
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Structure of Anemonia sulcata red fluorescent protein asRFP
To be Published
7S27
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BU of 7s27 by Molmil
Crystal structure of hen egg white lysozyme
分子名称: Lysozyme C, SODIUM ION
著者Lima, L.M.T.R, Ramos, N.G, Ribeiro, F.S.
登録日2021-09-03
公開日2022-07-13
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献The reproducible normality of the crystallographic B-factor.
Anal.Biochem., 645, 2022
5KBH
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BU of 5kbh by Molmil
CRYSTAL STRUCTURE OF THE AROMATIC SENSOR DOMAIN OF MOPR IN COMPLEX WITH 3-CHLORO-PHENOL
分子名称: 3-CHLOROPHENOL, MopR, ZINC ION
著者Ray, S, Anand, R, Panjikar, S.
登録日2016-06-03
公開日2016-07-13
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (2.55 Å)
主引用文献Structural Basis of Selective Aromatic Pollutant Sensing by the Effector Binding Domain of MopR, an NtrC Family Transcriptional Regulator.
Acs Chem.Biol., 11, 2016
7S2G
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BU of 7s2g by Molmil
Crystal structure of hen egg white lysozyme
分子名称: Lysozyme C, SODIUM ION
著者Lima, L.M.T.R, Ramos, N.G, Ribeiro, F.S.
登録日2021-09-03
公開日2022-07-13
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献The reproducible normality of the crystallographic B-factor.
Anal.Biochem., 645, 2022
7S29
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BU of 7s29 by Molmil
Crystal structure of hen egg white lysozyme
分子名称: Lysozyme C, SODIUM ION
著者Lima, L.M.T.R, Ramos, N.G, Ribeiro, F.S.
登録日2021-09-03
公開日2022-07-13
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献The reproducible normality of the crystallographic B-factor.
Anal.Biochem., 645, 2022
7S2C
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BU of 7s2c by Molmil
Crystal structure of hen egg white lysozyme
分子名称: Lysozyme C, SODIUM ION
著者Lima, L.M.T.R, Ramos, N.G, Ribeiro, F.S.
登録日2021-09-03
公開日2022-07-13
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献The reproducible normality of the crystallographic B-factor.
Anal.Biochem., 645, 2022
3CG7
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BU of 3cg7 by Molmil
Crystal structure of cell-death related nuclease 4 (CRN-4)
分子名称: Cell death-related nuclease 4, ZINC ION
著者Hsiao, Y.-Y, Yuan, H.S.
登録日2008-03-05
公開日2008-12-30
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Crystal structure of CRN-4: implications for domain function in apoptotic DNA degradation
Mol.Cell.Biol., 29, 2009
8SPJ
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BU of 8spj by Molmil
Crystal Structure of SARS-CoV-2 Main Protease (Mpro) N28T Mutant
分子名称: 3C-like proteinase nsp5
著者Kohaal, N, Lewandowski, E.M, Wang, J, Chen, Y.
登録日2023-05-03
公開日2023-05-24
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (2.08 Å)
主引用文献Crystal Structure of SARS-CoV-2 Main Protease (Mpro) N28T Mutant
To Be Published

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