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6ETM
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BU of 6etm by Molmil
Atomic resolution structure of RNase A (data collection 3)
Descriptor: ISOPROPYL ALCOHOL, Ribonuclease pancreatic
Authors:Caterino, M, Vergara, A, Merlino, A.
Deposit date:2017-10-27
Release date:2018-02-21
Method:X-RAY DIFFRACTION (0.92 Å)
Cite:Raman-markers of X-ray radiation damage of proteins.
Int. J. Biol. Macromol., 111, 2018
7A2X
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BU of 7a2x by Molmil
Crystal structure of the Fyn SH3 domain L112V-S114N-S115T-E121L-R123H mutant in complex with VSL12 at pH 5.0
Descriptor: Tyrosine-protein kinase Fyn, VSL12 high affinity synthetic peptide acetylated in the amino-terminus
Authors:Camara-Artigas, A, Plaza-Garrido, M, Salinas-Garcia, M.C.
Deposit date:2020-08-18
Release date:2021-08-25
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (0.92 Å)
Cite:Crystal structure of the Fyn SH3 domain L112V-S114N-S115T-E121L-R123H mutant in complex with VSL12 at pH 5.0
To be published
6UWW
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BU of 6uww by Molmil
Crystal structure of dihydrofolate reductase from Mycobacterium ulcerans with P218 inhibitor
Descriptor: 3-(2-{3-[(2,4-diamino-6-ethylpyrimidin-5-yl)oxy]propoxy}phenyl)propanoic acid, Dihydrofolate reductase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
Authors:Seattle Structural Genomics Center for Infectious Disease, Seattle Structural Genomics Center for Infectious Disease (SSGCID)
Deposit date:2019-11-05
Release date:2020-11-11
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (0.92 Å)
Cite:Crystal structure of dihydrofolate reductase from Mycobacterium ulcerans with SDDC-0001565 inhibitor
to be published
5DKM
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BU of 5dkm by Molmil
S. erythraea trypsin Michaelis-Menten complex
Descriptor: Trypsin
Authors:Blankenship, E, Lodowski, D.T.
Deposit date:2015-09-03
Release date:2017-03-08
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (0.92 Å)
Cite:High resolution structures of S. erythraeus trypsin throughout the catalytic cycle
To be Published
6ETN
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BU of 6etn by Molmil
Atomic resolution structure of RNase A (data collection 4)
Descriptor: ISOPROPYL ALCOHOL, Ribonuclease pancreatic
Authors:Caterino, M, Vergara, A, Merlino, A.
Deposit date:2017-10-27
Release date:2018-02-21
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (0.92 Å)
Cite:Raman-markers of X-ray radiation damage of proteins.
Int. J. Biol. Macromol., 111, 2018
6F7R
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BU of 6f7r by Molmil
AKR1B1 at 0.03 MGy radiation dose.
Descriptor: Aldose reductase, CITRIC ACID, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
Authors:Castellvi, A, Juanhuix, J.
Deposit date:2017-12-11
Release date:2019-03-13
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (0.92 Å)
Cite:Efficacy of aldose reductase inhibitors is affected by oxidative stress induced under X-ray irradiation.
Sci Rep, 9, 2019
2XJH
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BU of 2xjh by Molmil
Structure and Copper-binding Properties of Methanobactins from Methylosinus trichosporium OB3b
Descriptor: COPPER (II) ION, METHANOBACTIN MB-OB3B, SODIUM ION
Authors:El-Ghazouani, A, Basle, A, Firbank, S.J, Knapp, C.W, Gray, J, Graham, D.W, Dennison, C.
Deposit date:2010-07-06
Release date:2011-02-02
Last modified:2019-05-22
Method:X-RAY DIFFRACTION (0.92 Å)
Cite:Copper-Binding Properties and Structures of Methanobactins from Methylosinus Trichosporium Ob3B.
Inorg.Chem., 50, 2011
5RCK
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BU of 5rck by Molmil
PanDDA analysis group deposition -- Endothiapepsin ground state model 05
Descriptor: ACETATE ION, DI(HYDROXYETHYL)ETHER, Endothiapepsin, ...
Authors:Weiss, M.S, Wollenhaupt, J, Metz, A, Barthel, T, Lima, G.M.A, Heine, A, Mueller, U, Klebe, G.
Deposit date:2020-03-24
Release date:2020-06-03
Last modified:2020-06-17
Method:X-RAY DIFFRACTION (0.92 Å)
Cite:F2X-Universal and F2X-Entry: Structurally Diverse Compound Libraries for Crystallographic Fragment Screening.
Structure, 28, 2020
3WGX
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BU of 3wgx by Molmil
Crystal structure of ERp46 Trx2 in a complex with Prx4 C-term
Descriptor: GLYCEROL, Peroxiredoxin-4, Thioredoxin domain-containing protein 5
Authors:Inaba, K, Suzuki, M, Kojima, R.
Deposit date:2013-08-13
Release date:2014-06-25
Method:X-RAY DIFFRACTION (0.92 Å)
Cite:Radically different thioredoxin domain arrangement of ERp46, an efficient disulfide bond introducer of the mammalian PDI family
Structure, 22, 2014
5R31
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BU of 5r31 by Molmil
PanDDA analysis group deposition -- Auto-refined data of Endothiapepsin for ground state model 25, DMSO-Free
Descriptor: Endothiapepsin
Authors:Wollenhaupt, J, Metz, A, Barthel, T, Lima, G.M.A, Heine, A, Mueller, U, Klebe, G, Weiss, M.S.
Deposit date:2020-02-13
Release date:2020-06-03
Last modified:2020-07-08
Method:X-RAY DIFFRACTION (0.92 Å)
Cite:F2X-Universal and F2X-Entry: Structurally Diverse Compound Libraries for Crystallographic Fragment Screening.
Structure, 28, 2020
7XBC
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BU of 7xbc by Molmil
The 0.92 angstrom X-ray structure of the human heart fatty acid-binding protein complexed with lignoceric acid
Descriptor: 2-amino-2-deoxy-6-O-phosphono-alpha-D-glucopyranose, Fatty acid-binding protein, heart, ...
Authors:Sugiyama, S, Matsuoka, S, Tsuchikawa, H, Sonoyama, M, Inoue, Y, Hayashi, F, Murata, M.
Deposit date:2022-03-21
Release date:2023-03-29
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (0.92 Å)
Cite:The 0.92 angstrom X-ray structure of the human heart fatty acid-binding protein complexed with lignoceric acid
To Be Published
5R33
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BU of 5r33 by Molmil
PanDDA analysis group deposition -- Auto-refined data of Endothiapepsin for ground state model 27, DMSO-Free
Descriptor: Endothiapepsin
Authors:Wollenhaupt, J, Metz, A, Barthel, T, Lima, G.M.A, Heine, A, Mueller, U, Klebe, G, Weiss, M.S.
Deposit date:2020-02-13
Release date:2020-06-03
Last modified:2020-07-08
Method:X-RAY DIFFRACTION (0.92 Å)
Cite:F2X-Universal and F2X-Entry: Structurally Diverse Compound Libraries for Crystallographic Fragment Screening.
Structure, 28, 2020
3X0J
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BU of 3x0j by Molmil
ADP ribose pyrophosphatase from Thermus thermophilus HB8 in apo state at 0.92 angstrom resolution
Descriptor: ADP-ribose pyrophosphatase, GLYCEROL, SULFATE ION
Authors:Furuike, Y, Akita, Y, Miyahara, I, Kamiya, N.
Deposit date:2014-10-16
Release date:2016-04-27
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (0.92 Å)
Cite:ADP-Ribose Pyrophosphatase Reaction in Crystalline State Conducted by Consecutive Binding of Two Manganese(II) Ions as Cofactors
Biochemistry, 55, 2016
1RB9
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BU of 1rb9 by Molmil
RUBREDOXIN FROM DESULFOVIBRIO VULGARIS REFINED ANISOTROPICALLY AT 0.92 ANGSTROMS RESOLUTION
Descriptor: FE (II) ION, RUBREDOXIN, SULFATE ION
Authors:Dauter, Z, Butterworth, S, Sieker, L.C, Sheldrick, G, Wilson, K.S.
Deposit date:1997-12-21
Release date:1999-02-16
Last modified:2023-08-09
Method:X-RAY DIFFRACTION (0.92 Å)
Cite:Anisotropic Refinement of Rubredoxin from Desulfovibrio Vulgaris
To be Published
6CNW
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BU of 6cnw by Molmil
STRUCTURE OF HUMANIZED SINGLE DOMAIN ANTIBODY SD84
Descriptor: ACETATE ION, DI(HYDROXYETHYL)ETHER, humanized antibody SD84h
Authors:Luo, J, Obmolova, O.
Deposit date:2018-03-09
Release date:2018-11-14
Method:X-RAY DIFFRACTION (0.92 Å)
Cite:Universal protection against influenza infection by a multidomain antibody to influenza hemagglutinin.
Science, 362, 2018
8PB7
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BU of 8pb7 by Molmil
PsiM in complex with sinefungin and baeocystin
Descriptor: Baeocystin, CHLORIDE ION, Psilocybin synthase, ...
Authors:Werten, S, Hudspeth, J, Rupp, B.
Deposit date:2023-06-08
Release date:2024-04-03
Last modified:2024-04-10
Method:X-RAY DIFFRACTION (0.92 Å)
Cite:Methyl transfer in psilocybin biosynthesis.
Nat Commun, 15, 2024
6HSA
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BU of 6hsa by Molmil
The crystal structure of type II Dehydroquinase from Butyrivibrio crossotus DSM 2876
Descriptor: 2-{2-[2-2-(METHOXY-ETHOXY)-ETHOXY]-ETHOXY}-ETHANOL, 3-dehydroquinate dehydratase, CITRATE ANION, ...
Authors:Lapthorn, A.J, Roszak, A.W.
Deposit date:2018-09-29
Release date:2019-10-23
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (0.92 Å)
Cite:The crystal structure of type II Dehydroquinase from Butyrivibrio crossotus DSM 2876
To Be Published
2GBA
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BU of 2gba by Molmil
Reduced Cu(I) form at pH 4 of P52G mutant of amicyanin
Descriptor: COPPER (I) ION, amicyanin
Authors:Ma, J.K, Carrell, C.J, Mathews, F.S, Davidson, V.L.
Deposit date:2006-03-10
Release date:2006-08-01
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (0.92 Å)
Cite:Site-Directed Mutagenesis of Proline 52 To Glycine in Amicyanin Converts a True Electron Transfer Reaction into One that Is Conformationally Gated.
Biochemistry, 45, 2006
3W7Y
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BU of 3w7y by Molmil
0.92A structure of 2Zn human insulin at 100K
Descriptor: Insulin, ZINC ION
Authors:Sakabe, N, Sakabe, K, Sasaki, K, Murayoshi, M.
Deposit date:2013-03-11
Release date:2013-07-03
Last modified:2018-03-07
Method:X-RAY DIFFRACTION (0.92 Å)
Cite:0.92A structure of 2Zn human insulin at 100K
To be Published
1L9L
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BU of 1l9l by Molmil
GRANULYSIN FROM HUMAN CYTOLYTIC T LYMPHOCYTES
Descriptor: 3[N-MORPHOLINO]PROPANE SULFONIC ACID, ETHANOL, Granulysin, ...
Authors:Anderson, D.H, Sawaya, M.R, Cascio, D, Ernst, W, Krensky, A, Modlin, R, Eisenberg, D.
Deposit date:2002-03-25
Release date:2002-11-06
Last modified:2017-09-13
Method:X-RAY DIFFRACTION (0.92 Å)
Cite:Granulysin Crystal Structure and a Structure-Derived Lytic Mechanism
J.Mol.Biol., 325, 2002
2PPN
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BU of 2ppn by Molmil
Crystal structure of FKBP12
Descriptor: FK506-binding protein 1A
Authors:Szep, S, Park, S, VanDuyne, G.D, Saven, J.G.
Deposit date:2007-04-30
Release date:2008-05-27
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (0.92 Å)
Cite:Structural coupling between FKBP12 and buried water.
Proteins, 74, 2009
1PWM
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BU of 1pwm by Molmil
Crystal structure of human Aldose Reductase complexed with NADP and Fidarestat
Descriptor: (2S,4S)-2-AMINOFORMYL-6-FLUORO-SPIRO[CHROMAN-4,4'-IMIDAZOLIDINE]-2',5'-DIONE, CHLORIDE ION, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
Authors:El-Kabbani, O, Darmanin, C, Schneider, T.R, Hazemann, I, Ruiz, F, Oka, M, Joachimiak, A, Schulze-Briese, C, Tomizaki, T, Mitschler, A, Podjarny, A.
Deposit date:2003-07-02
Release date:2004-02-24
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (0.92 Å)
Cite:Ultrahigh resolution drug design. II. Atomic resolution structures of human aldose reductase holoenzyme complexed with Fidarestat and Minalrestat: implications for the binding of cyclic imide inhibitors
PROTEINS, 55, 2004
4E1U
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BU of 4e1u by Molmil
[Ru(bpy)2 dppz]2+ bound to DNA
Descriptor: 5'-D(*CP*GP*GP*AP*AP*AP*TP*TP*AP*CP*CP*G)-3', BARIUM ION, Delta-[Ru(bpy)2dppz]2+
Authors:Song, H, Kaiser, J.T, Barton, J.K.
Deposit date:2012-03-07
Release date:2012-06-20
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (0.92 Å)
Cite:Crystal structure of delta-[Ru(bpy)2dppz]2+ bound to mismatched DNA reveals side-by-side metalloinsertion and intercalation.
Nat Chem, 4, 2012
1VB0
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BU of 1vb0 by Molmil
Atomic resolution structure of atratoxin-b, one short-chain neurotoxin from Naja atra
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, Cobrotoxin b, SULFATE ION
Authors:Lou, X, Liu, Q, Teng, M, Niu, L, Huang, Q, Hao, Q.
Deposit date:2004-02-20
Release date:2004-12-21
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (0.92 Å)
Cite:The atomic resolution crystal structure of atratoxin determined by single wavelength anomalous diffraction phasing
J.Biol.Chem., 279, 2004
1IQZ
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BU of 1iqz by Molmil
OXIDIZED [4Fe-4S] FERREDOXIN FROM BACILLUS THERMOPROTEOLYTICUS (FORM I)
Descriptor: Ferredoxin, IRON/SULFUR CLUSTER, SULFATE ION
Authors:Fukuyama, K, Okada, T, Kakuta, Y, Takahashi, Y.
Deposit date:2001-08-30
Release date:2002-02-13
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (0.92 Å)
Cite:Atomic resolution structures of oxidized [4Fe-4S] ferredoxin from Bacillus thermoproteolyticus in two crystal forms: systematic distortion of [4Fe-4S] cluster in the protein.
J.Mol.Biol., 315, 2002

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