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5RDH
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BU of 5rdh by Molmil
PanDDA analysis group deposition -- Endothiapepsin ground state model 39
分子名称: Endothiapepsin
著者Weiss, M.S, Wollenhaupt, J, Metz, A, Barthel, T, Lima, G.M.A, Heine, A, Mueller, U, Klebe, G.
登録日2020-03-24
公開日2020-06-03
最終更新日2020-06-17
実験手法X-RAY DIFFRACTION (0.85 Å)
主引用文献F2X-Universal and F2X-Entry: Structurally Diverse Compound Libraries for Crystallographic Fragment Screening.
Structure, 28, 2020
2PFH
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Complex of Aldose Reductase with NADP+ and simaltaneously bound competetive inhibitors Fidarestat and IDD594. Concentration of Fidarestat in soaking solution is less than concentration of IDD594.
分子名称: (2S,4S)-2-AMINOFORMYL-6-FLUORO-SPIRO[CHROMAN-4,4'-IMIDAZOLIDINE]-2',5'-DIONE, Aldose reductase, CHLORIDE ION, ...
著者Petrova, T, Hazemann, I, Cousido, A, Mitschler, A, Ginell, S, Joachimiak, A, Podjarny, A.
登録日2007-04-05
公開日2007-04-17
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (0.85 Å)
主引用文献Crystal packing modifies ligand binding affinity: The case of aldose reductase.
Proteins, 80, 2012
3PYP
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PHOTOACTIVE YELLOW PROTEIN, CRYOTRAPPED EARLY LIGHT CYCLE INTERMEDIATE
分子名称: 4'-HYDROXYCINNAMIC ACID, PHOTOACTIVE YELLOW PROTEIN
著者Genick, U.K, Soltis, S.M, Kuhn, P, Canestrelli, I.L, Getzoff, E.D.
登録日1998-07-28
公開日1999-06-01
最終更新日2023-08-09
実験手法X-RAY DIFFRACTION (0.85 Å)
主引用文献Structure at 0.85 A resolution of an early protein photocycle intermediate.
Nature, 392, 1998
1X8Q
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0.85 A Crystal Structure Of Nitrophorin 4 From Rhodnius Prolixus in Complex with Water at pH 5.6
分子名称: Nitrophorin 4, PROTOPORPHYRIN IX CONTAINING FE
著者Kondrashov, D.A, Roberts, S.A, Weichsel, A, Montfort, W.R.
登録日2004-08-18
公開日2004-10-05
最終更新日2023-08-23
実験手法X-RAY DIFFRACTION (0.85 Å)
主引用文献Protein functional cycle viewed at atomic resolution: conformational change and mobility in nitrophorin 4 as a function of pH and NO binding
Biochemistry, 43, 2004
1X8P
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0.85 A Crystal Structure Of Nitrophorin 4 From Rhodnius Prolixus Complexed With Ammonia at pH 7.4
分子名称: AMMONIA, Nitrophorin 4, PROTOPORPHYRIN IX CONTAINING FE
著者Kondrashov, D.A, Roberts, S.A, Weichsel, A, Montfort, W.R.
登録日2004-08-18
公開日2004-10-05
最終更新日2023-08-23
実験手法X-RAY DIFFRACTION (0.85 Å)
主引用文献Protein functional cycle viewed at atomic resolution: conformational change and mobility in nitrophorin 4 as a function of pH and NO binding
Biochemistry, 43, 2004
1M40
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BU of 1m40 by Molmil
ULTRA HIGH RESOLUTION CRYSTAL STRUCTURE OF TEM-1
分子名称: BETA-LACTAMASE TEM, PHOSPHATE ION, PINACOL[[2-AMINO-ALPHA-(1-CARBOXY-1-METHYLETHOXYIMINO)-4-THIAZOLEACETYL]AMINO]METHANEBORONATE, ...
著者Minasov, G, Wang, X, Shoichet, B.K.
登録日2002-07-01
公開日2002-07-17
最終更新日2021-10-27
実験手法X-RAY DIFFRACTION (0.85 Å)
主引用文献An ultrahigh resolution structure of TEM-1 beta-lactamase suggests a role for Glu166 as the general base in acylation.
J.Am.Chem.Soc., 124, 2002
4PTH
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BU of 4pth by Molmil
Ensemble model for Escherichia coli dihydrofolate reductase at 100K
分子名称: Dihydrofolate reductase, FOLIC ACID, MANGANESE (II) ION, ...
著者Keedy, D.A, van den Bedem, H, Sivak, D.A, Petsko, G.A, Ringe, D, Wilson, M.A, Fraser, J.S.
登録日2014-03-10
公開日2014-05-14
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (0.85 Å)
主引用文献Crystal Cryocooling Distorts Conformational Heterogeneity in a Model Michaelis Complex of DHFR.
Structure, 22, 2014
3QPA
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BU of 3qpa by Molmil
Structure of Fusarium Solani Cutinase expressed in Pichia pastoris
分子名称: Cutinase
著者Lu, A, Gosser, Y, Montclare, J.K, Liu, Z, Kong, X.
登録日2011-02-11
公開日2012-02-29
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (0.85 Å)
主引用文献Structure of Fusarium Solani Cutinase expressed in Pichia pastoris
To be Published
4PSY
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BU of 4psy by Molmil
100K crystal structure of Escherichia coli dihydrofolate reductase
分子名称: Dihydrofolate reductase, FOLIC ACID, MANGANESE (II) ION, ...
著者Wilson, M.A, Wan, Q, Bennet, B.C, Dealwis, C, Ringe, D, Petsko, G.A.
登録日2014-03-08
公開日2014-05-14
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (0.85 Å)
主引用文献Toward resolving the catalytic mechanism of dihydrofolate reductase using neutron and ultrahigh-resolution X-ray crystallography.
Proc.Natl.Acad.Sci.USA, 22, 2014
1MC2
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BU of 1mc2 by Molmil
monomeric LYS-49 phospholipase A2 homologue purified from AG
分子名称: Acutohaemonlysin, ISOPROPYL ALCOHOL
著者Liu, Q, Huang, Q.Q, Zhang, R.G, Weeks, C.M, Jelsch, C, Teng, M.K, Niu, L.W.
登録日2002-08-05
公開日2002-08-21
最終更新日2018-02-14
実験手法X-RAY DIFFRACTION (0.85 Å)
主引用文献The crystal structure of a novel, inactive, lysine 49 PLA2 from Agkistrodon acutus venom: an ultrahigh resolution, AB initio structure determination
J.Biol.Chem., 278, 2003
5NQI
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BU of 5nqi by Molmil
E.coli 16S rRNA Sarcin-Ricin Loop containing a 5-hydroxymethylcytosine modification
分子名称: E.Coli 27-mer SRL RNA
著者Ennifar, E, Micura, R.
登録日2017-04-20
公開日2017-07-26
最終更新日2019-10-16
実験手法X-RAY DIFFRACTION (0.851 Å)
主引用文献Synthesis, Thermodynamic Properties, and Crystal Structure of RNA Oligonucleotides Containing 5-Hydroxymethylcytosine.
J. Org. Chem., 82, 2017
5MRX
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BU of 5mrx by Molmil
27-nt SRL with a 5-hydroxymethyl cytidine modification
分子名称: RNA (27-MER)
著者Ennifar, E, Micura, R.
登録日2016-12-28
公開日2018-01-17
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (0.851 Å)
主引用文献Synthesis, Thermodynamic Properties, and Crystal Structure of RNA Oligonucleotides Containing 5-Hydroxymethylcytosine
J.Org.Chem., 2017
6KL1
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BU of 6kl1 by Molmil
Crystal structure of the S65T/F99S/M153T/V163A variant of non-deuterated GFP at pD 8.5
分子名称: Green fluorescent protein
著者Tai, Y, Takaba, K, Hanazono, Y, Dao, H.A, Miki, K, Takeda, K.
登録日2019-07-28
公開日2019-12-11
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (0.851 Å)
主引用文献X-ray crystallographic studies on the hydrogen isotope effects of green fluorescent protein at sub-angstrom resolutions
Acta Crystallogr.,Sect.D, 75, 2019
6Q01
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BU of 6q01 by Molmil
TDP2 UBA Domain Bound to Ubiquitin at 0.85 Angstroms Resolution, Crystal Form 2
分子名称: 1,2-ETHANEDIOL, BENZOIC ACID, MAGNESIUM ION, ...
著者Schellenberg, M.J, Krahn, J.M, Williams, R.S.
登録日2019-08-01
公開日2020-04-29
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (0.851 Å)
主引用文献Ubiquitin stimulated reversal of topoisomerase 2 DNA-protein crosslinks by TDP2.
Nucleic Acids Res., 48, 2020
5D9E
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BU of 5d9e by Molmil
Crystal Structure of the Proline-rich Lasso Peptide Caulosegnin II
分子名称: CHLORIDE ION, Caulosegnin II
著者Fage, C.D, Hegemann, J.D, Harms, K, Marahiel, M.A.
登録日2015-08-18
公開日2016-02-17
最終更新日2019-05-08
実験手法X-RAY DIFFRACTION (0.859 Å)
主引用文献The ring residue proline 8 is crucial for the thermal stability of the lasso peptide caulosegnin II.
Mol Biosyst, 12, 2016
5MNN
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BU of 5mnn by Molmil
Cationic trypsin in complex with N-amidinopiperidine (deuterated sample at 100 K)
分子名称: CALCIUM ION, Cationic trypsin, SULFATE ION, ...
著者Schiebel, J, Heine, A, Klebe, G.
登録日2016-12-13
公開日2018-01-17
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (0.859 Å)
主引用文献Intriguing role of water in protein-ligand binding studied by neutron crystallography on trypsin complexes.
Nat Commun, 9, 2018
1MUW
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BU of 1muw by Molmil
The 0.86 Angstrom Structure of Xylose Isomerase
分子名称: HYDROXIDE ION, MAGNESIUM ION, MANGANESE (II) ION, ...
著者Fenn, T.D, Ringe, D, Petsko, G.A.
登録日2002-09-24
公開日2002-11-06
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (0.86 Å)
主引用文献Active Site Dynamics at 0.86A: Crystallographic Analysis of a Metal-Mediated Hydride Shift
To be Published
7FDT
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BU of 7fdt by Molmil
The 0.86 angstrom X-ray structure of the human heart fatty acid-binding protein complexed with elaidic acid
分子名称: 9-OCTADECENOIC ACID, Fatty acid-binding protein, heart, ...
著者Sugiyama, S, Kakinouchi, K, Matsuoka, S, Tsuchikawa, H, Sonoyama, M, Inoue, Y, Hayashi, F, Murata, M.
登録日2021-07-17
公開日2022-07-20
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (0.86 Å)
主引用文献The 0.86 angstrom X-ray structure of the human heart fatty acid-binding protein complexed with octanoic acid
To Be Published
7FDU
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BU of 7fdu by Molmil
The 0.86 angstrom X-ray structure of the human heart fatty acid-binding protein complexed with heptadecanoic acid
分子名称: Fatty acid-binding protein, heart, HEXAETHYLENE GLYCOL, ...
著者Sugiyama, S, Kakinouchi, K, Matsuoka, S, Tsuchikawa, H, Sonoyama, M, Inoue, Y, Hayashi, F, Murata, M.
登録日2021-07-18
公開日2022-07-20
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (0.86 Å)
主引用文献The 0.86 angstrom X-ray structure of the human heart fatty acid-binding protein complexed with heptadecanoic acid
To Be Published
5AVD
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BU of 5avd by Molmil
The 0.86 angstrom structure of elastase crystallized in high-strength agarose hydrogel
分子名称: Chymotrypsin-like elastase family member 1, SULFATE ION
著者Sugiyama, S, Shimizu, N, Maruyama, M, Sazaki, G, Adachi, H, Takano, K, Murakami, S, Inoue, T, Mori, Y, Matsumura, H.
登録日2015-06-15
公開日2015-07-08
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (0.86 Å)
主引用文献Growth of protein crystals in hydrogels prevents osmotic shock
J.Am.Chem.Soc., 134, 2012
1ALZ
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BU of 1alz by Molmil
GRAMICIDIN D FROM BACILLUS BREVIS (ETHANOL SOLVATE)
分子名称: ETHANOL, ILE-GRAMICIDIN C, VAL-GRAMICIDIN A
著者Burkhart, B.M, Pangborn, W.A, Duax, W.L, Langs, D.A.
登録日1997-06-06
公開日1998-03-04
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (0.86 Å)
主引用文献Heterodimer Formation and Crystal Nucleation of Gramicidin D
Biophys.J., 75, 1998
7FBF
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BU of 7fbf by Molmil
The 0.86 angstrom X-ray structure of the human heart fatty acid-binding protein complexed with octanoic acid
分子名称: Fatty acid-binding protein, heart, HEXAETHYLENE GLYCOL, ...
著者Sugiyama, S, Kakinouchi, K, Matsuoka, S, Tsuchikawa, H, Sonoyama, M, Inoue, Y, Hayashi, F, Murata, M.
登録日2021-07-09
公開日2022-07-13
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (0.86 Å)
主引用文献The 0.86 angstrom X-ray structure of the human heart fatty acid-binding protein complexed with octanoic acid
To Be Published
7WJ1
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BU of 7wj1 by Molmil
The 0.86 angstrom X-ray structure of the human heart fatty acid-binding protein complexed with arachidonic acid
分子名称: ARACHIDONIC ACID, Fatty acid-binding protein, heart, ...
著者Sugiyama, S, Kakinouchi, K, Nakano, R, Matsuoka, S, Tsuchikawa, H, Sonoyama, M, Inoue, Y, Hayashi, F, Murata, M.
登録日2022-01-05
公開日2023-01-25
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (0.86 Å)
主引用文献The 0.86 angstrom X-ray structure of the human heart fatty acid-binding protein complexed with arachidonic acid
To Be Published
7X48
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The 0.86 angstrom X-ray structure of the human heart fatty acid-binding protein complexed with pelargonic acid
分子名称: Fatty acid-binding protein, heart, HEXAETHYLENE GLYCOL, ...
著者Sugiyama, S, Matsuoka, S, Tsuchikawa, H, Sonoyama, M, Inoue, Y, Hayashi, F, Murata, M.
登録日2022-03-02
公開日2023-03-08
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (0.86 Å)
主引用文献The 0.86 angstrom X-ray structure of the human heart fatty acid-binding protein complexed with pelargonic acid
To Be Published
4TKB
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BU of 4tkb by Molmil
The 0.86 angstrom X-ray structure of the human heart fatty acid-binding protein complexed with lauric acid
分子名称: Fatty acid-binding protein, heart, HEXAETHYLENE GLYCOL, ...
著者Sugiyama, S, Matsuoka, S, Mizohata, E, Matsuoka, D, Ishida, H, Hirose, M, Kakinouchi, K, Hara, T, Murakami, S, Inoue, T, Murata, M.
登録日2014-05-26
公開日2015-01-28
最終更新日2024-03-20
実験手法X-RAY DIFFRACTION (0.86 Å)
主引用文献Water-mediated recognition of simple alkyl chains by heart-type Fatty-Acid-binding protein
Angew.Chem.Int.Ed.Engl., 54, 2015

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