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1DPN
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BU of 1dpn by Molmil
B-DODECAMER CGCGAA(TAF)TCGCG WITH INCORPORATED 2'-DEOXY-2'-FLUORO-ARABINO-FURANOSYL THYMINE
Descriptor: DNA (5'-D(*CP*GP*CP*GP*AP*AP*(TAF)P*TP*CP*GP*CP*G)-3'), MAGNESIUM ION
Authors:Egli, M, Tereshko, V, Teplova, M, Minasov, G, Joachimiak, A, Sanishvili, R, Weeks, C.M, Miller, R, Maier, M.A, An, H, Dan Cook, P, Manoharan, M.
Deposit date:1999-12-27
Release date:2000-04-04
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:X-ray crystallographic analysis of the hydration of A- and B-form DNA at atomic resolution.
Biopolymers, 48, 1998
6J93
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BU of 6j93 by Molmil
Crystal structure of Peptidyl-tRNA hydrolase from Acinetobacter baumannii at 0.95 A resolution
Descriptor: 1,2-ETHANEDIOL, Peptidyl-tRNA hydrolase
Authors:Viswanathan, V, Sharma, P, Singh, P.K, Iqbal, N, Sharma, S, Singh, T.P.
Deposit date:2019-01-21
Release date:2019-02-06
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:Crystal structure of Peptidyl-tRNA hydrolase form apo at 0.95 A resolution.
To Be Published
5O2X
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BU of 5o2x by Molmil
Extended catalytic domain of H. jecorina LPMO9A a.k.a EG4
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, COPPER (II) ION, Glycoside hydrolase family 61, ...
Authors:Hansson, H, Karkehabadi, S, Mikkelsen, N.E, Sandgren, M, Kelemen, B, Kaper, T.
Deposit date:2017-05-23
Release date:2017-09-20
Last modified:2020-07-29
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:High-resolution structure of a lytic polysaccharide monooxygenase from Hypocrea jecorina reveals a predicted linker as an integral part of the catalytic domain.
J. Biol. Chem., 292, 2017
4M6E
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BU of 4m6e by Molmil
The high resolution structure of tyrocidine A reveals an amphipathic dimer
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, METHANOL, tyrocidine A
Authors:Loll, P.J, Economou, N.J, Nahoum, V.
Deposit date:2013-08-09
Release date:2014-03-19
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:The high resolution structure of tyrocidine A reveals an amphipathic dimer.
Biochim.Biophys.Acta, 1838, 2014
7AVJ
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BU of 7avj by Molmil
Streptococcal High Identity Repeats in Tandem (SHIRT) domain 2 from cell surface protein SGO_0707
Descriptor: LPXTG cell wall surface protein
Authors:Whelan, F, Jenkins, H.T, Potts, J.R.
Deposit date:2020-11-05
Release date:2021-06-09
Last modified:2024-05-15
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:Periscope Proteins are variable-length regulators of bacterial cell surface interactions.
Proc.Natl.Acad.Sci.USA, 118, 2021
3DK9
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BU of 3dk9 by Molmil
Catalytic cycle of human glutathione reductase near 1 A resolution
Descriptor: FLAVIN-ADENINE DINUCLEOTIDE, Glutathione reductase, SULFATE ION
Authors:Berkholz, D.S, Faber, H.R, Savvides, S.N, Karplus, P.A.
Deposit date:2008-06-24
Release date:2008-08-05
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:Catalytic cycle of human glutathione reductase near 1 A resolution.
J.Mol.Biol., 382, 2008
1OB4
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BU of 1ob4 by Molmil
Cephaibol A
Descriptor: CEPHAIBOL A, ETHANOL
Authors:Bunkoczi, G, Schiell, M, Vertesy, L, Sheldrick, G.M.
Deposit date:2003-01-24
Release date:2003-12-11
Last modified:2019-05-22
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:Crystal Structures of Cephaibols
J.Pept.Sci., 9, 2003
2VU6
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BU of 2vu6 by Molmil
Atomic resolution (0.95 A) structure of purified Thaumatin I grown in sodium meso-tartrate at 19 C.
Descriptor: GLYCEROL, Thaumatin-1
Authors:Jakoncic, J, Asherie, N, Ginsberg, C.
Deposit date:2008-05-21
Release date:2009-07-14
Last modified:2019-02-20
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:Tartrate Chirality Determines Thaumatin Crystal Habit
Cryst.Growth Des., 9, 2009
1BRF
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BU of 1brf by Molmil
Rubredoxin (Wild Type) from Pyrococcus Furiosus
Descriptor: FE (III) ION, PROTEIN (RUBREDOXIN)
Authors:Bau, R, Rees, D.C, Kurtz, D.M, Scott, R.A, Huang, H, Adams, M.W.W, Eidsness, M.K.
Deposit date:1998-08-24
Release date:1998-09-02
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:Crystal Structure of Rubredoxin from Pyrococcus Furiosus at 0.95 Angstroms Resolution, and the structures of N-terminal methionine and formylmethionine variants of Pf Rd. Contributions of N-terminal interactions to thermostability
J.BIOL.INORG.CHEM., 3, 1998
5U3A
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BU of 5u3a by Molmil
Ultra High Resolution Crystal Structure of Human Pancreatic Alpha Amylase
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, CALCIUM ION, CHLORIDE ION, ...
Authors:Caner, S, Brayer, G.D.
Deposit date:2016-12-01
Release date:2017-12-06
Last modified:2022-04-27
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:Folding Then Binding vs Folding Through Binding in Macrocyclic Peptide Inhibitors of Human Pancreatic alpha-Amylase.
Acs Chem.Biol., 14, 2019
4XDX
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BU of 4xdx by Molmil
The crystal structure of soluble human interleukin 8 expressed in Pichia pastoris
Descriptor: Interleukin-8
Authors:Ostrov, D.A, Pompeu, Y.A, Jakoncic, J.J.
Deposit date:2014-12-20
Release date:2015-12-23
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:The crystal structure of soluble human interleukin 8 expressed in Pichia pastoris
To Be Published
1BXO
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BU of 1bxo by Molmil
ACID PROTEINASE (PENICILLOPEPSIN) (E.C.3.4.23.20) COMPLEX WITH PHOSPHONATE INHIBITOR: METHYL CYCLO[(2S)-2-[[(1R)-1-(N-(L-N-(3-METHYLBUTANOYL)VALYL-L-ASPARTYL)AMINO)-3-METHYLBUT YL] HYDROXYPHOSPHINYLOXY]-3-(3-AMINOMETHYL) PHENYLPROPANOATE
Descriptor: GLYCEROL, METHYL CYCLO[(2S)-2-[[(1R)-1-(N-(L-N-(3-METHYLBUTANOYL)VALYL-L-ASPARTYL)AMINO)-3-METHYLBUTYL]HYDROXYPHOSPHINYLOXY]-3-(3-AMINOMETHYL)PHENYLPROPANOATE, PROTEIN (PENICILLOPEPSIN), ...
Authors:Khan, A.R, Parrish, J.C, Fraser, M.E, Smith, W.W, Bartlett, P.A, James, M.N.G.
Deposit date:1998-10-07
Release date:1998-10-14
Last modified:2023-08-09
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:Lowering the entropic barrier for binding conformationally flexible inhibitors to enzymes.
Biochemistry, 37, 1998
1HJ9
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BU of 1hj9 by Molmil
Atomic resolution structures of trypsin provide insight into structural radiation damage
Descriptor: ANILINE, BETA-TRYPSIN, CALCIUM ION, ...
Authors:Leiros, H.-K.S, McSweeney, S.M, Smalas, A.O.
Deposit date:2001-01-10
Release date:2002-01-04
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:Atomic Resolution Structure of Trypsin Provide Insight Into Structural Radiation Damage
Acta Crystallogr.,Sect.D, 57, 2001
5MEH
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BU of 5meh by Molmil
Crystal structure of alpha-1,2-mannosidase from Caulobacter K31 strain in complex with 1-deoxymannojirimycin
Descriptor: 1-DEOXYMANNOJIRIMYCIN, ACETATE ION, CALCIUM ION, ...
Authors:Males, A, Davies, G.J.
Deposit date:2016-11-14
Release date:2016-12-21
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:Conformational Behaviour of Azasugars Based on Mannuronic Acid.
Chembiochem, 18, 2017
2NX0
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BU of 2nx0 by Molmil
Ferrous nitrosyl blackfin tuna myoglobin
Descriptor: Myoglobin, NITRIC OXIDE, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Schreiter, E.R, Rodriguez, M.M, Weichsel, A, Montfort, W.R, Bonaventura, J.
Deposit date:2006-11-16
Release date:2007-05-08
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:S-nitrosylation-induced conformational change in blackfin tuna myoglobin.
J.Biol.Chem., 282, 2007
1KTH
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BU of 1kth by Molmil
The Anisotropic Refinement Of Kunitz Type Domain C5 at 0.95 Angstrom
Descriptor: Collagen alpha 3(VI) chain, PHOSPHATE ION
Authors:Arnoux, B, Ducruix, A, Prange, T.
Deposit date:2002-01-16
Release date:2002-02-06
Last modified:2023-08-16
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:Anisotropic behaviour of the C-terminal Kunitz-type domain of the alpha3 chain of human type VI collagen at atomic resolution (0.9 A).
Acta Crystallogr.,Sect.D, 58, 2002
7ASQ
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BU of 7asq by Molmil
Orotidine 5'-monophosphate decarboxylase-domain of human UMPS in complex with the reaction product UMP at 0.95 Angstrom resolution
Descriptor: GLYCEROL, SODIUM ION, SULFATE ION, ...
Authors:Rindfleisch, S, Rabe von Pappenheim, F.
Deposit date:2020-10-28
Release date:2021-11-24
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:Ground-state destabilization by electrostatic repulsion is not a driving force in orotidine-5-monophosphate decarboxylase catalysis
Nat Catal, 5, 2022
4Z8J
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BU of 4z8j by Molmil
Crystal structure of the SNX27 PDZ domain bound to the C-terminal PTHR PDZ binding motif
Descriptor: C-terminal PDZ binding motif from parathyroid hormone receptor (PTHR), Sorting nexin-27
Authors:Clairfeuille, T, Pavlos, N, Collins, B.M.
Deposit date:2015-04-09
Release date:2016-02-24
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:Role of SNX27-retromer in PTHR trafficking
To Be Published
6SY3
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BU of 6sy3 by Molmil
Cationic Trypsin in Complex with a D-DiPhe-Pro-pyridine derivative
Descriptor: (2~{S})-1-[(2~{R})-2-azanyl-3,3-diphenyl-propanoyl]-~{N}-(pyridin-4-ylmethyl)pyrrolidine-2-carboxamide, CALCIUM ION, Cationic Trypsin, ...
Authors:Ngo, K, Heine, A, Klebe, G.
Deposit date:2019-09-27
Release date:2020-05-13
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:Protein-Induced Change in Ligand Protonation during Trypsin and Thrombin Binding: Hint on Differences in Selectivity Determinants of Both Proteins?
J.Med.Chem., 63, 2020
1NKI
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BU of 1nki by Molmil
CRYSTAL STRUCTURE OF THE FOSFOMYCIN RESISTANCE PROTEIN A (FOSA) CONTAINING BOUND PHOSPHONOFORMATE
Descriptor: MANGANESE (II) ION, PHOSPHONOFORMIC ACID, POTASSIUM ION, ...
Authors:Rife, C.L, Pharris, R.E, Newcomer, M.E, Armstrong, R.N.
Deposit date:2003-01-03
Release date:2004-01-13
Last modified:2023-08-16
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:Phosphonoformate: a minimal transition state analogue inhibitor of the fosfomycin resistance protein, FosA.
Biochemistry, 43, 2004
3WGE
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BU of 3wge by Molmil
Crystal structure of ERp46 Trx2
Descriptor: GLYCEROL, Thioredoxin domain-containing protein 5
Authors:Inaba, K, Suzuki, M, Kojima, R.
Deposit date:2013-08-04
Release date:2014-06-25
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:Radically different thioredoxin domain arrangement of ERp46, an efficient disulfide bond introducer of the mammalian PDI family
Structure, 22, 2014
8I50
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BU of 8i50 by Molmil
Crystal structure of DNA octamer containing GuNA[Me,Me]
Descriptor: DNA (5'-D(*GP*(OIQ)P*GP*(BRU)P*AP*CP*AP*C)-3')
Authors:Aoyama, H, Obika, S, Yamaguchi, T.
Deposit date:2023-01-21
Release date:2023-08-09
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:Mechanism of the extremely high duplex-forming ability of oligonucleotides modified with N-tert-butylguanidine- or N-tert-butyl-N'- methylguanidine-bridged nucleic acids.
Nucleic Acids Res., 51, 2023
6SRY
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BU of 6sry by Molmil
Kemp Eliminase HG3.17 mutant Q50S, E47N, N300D Complexed with Transition State Analog 6-Nitrobenzotriazole
Descriptor: 6-NITROBENZOTRIAZOLE, Kemp Eliminase HG3.17 Q50S, E47N,N300D, ...
Authors:Bloch, J.S, Pinkas, D.M, Hilvert, D.
Deposit date:2019-09-06
Release date:2020-04-01
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:Contribution of Oxyanion Stabilization to Kemp Eliminase Efficiencyproficiency
Acs Catalysis, 2020
3RY2
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BU of 3ry2 by Molmil
Wild-type core streptavidin-biotin complex at atomic resolution
Descriptor: BIOTIN, GLYCEROL, Streptavidin
Authors:Stenkamp, R.E, Le Trong, I, Stayton, P.S, Lybrand, T.P.
Deposit date:2011-05-10
Release date:2011-08-24
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:Streptavidin and its biotin complex at atomic resolution.
Acta Crystallogr.,Sect.D, 67, 2011
7WPU
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BU of 7wpu by Molmil
The 0.95 angstrom X-ray structure of the human heart fatty acid-binding protein complexed with undecanoic acid
Descriptor: Fatty acid-binding protein, heart, PENTAETHYLENE GLYCOL, ...
Authors:Sugiyama, S, Matsuoka, S, Tsuchikawa, H, Sonoyama, M, Inoue, Y, Hayashi, F, Murata, M.
Deposit date:2022-01-24
Release date:2023-01-25
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:The 0.95 angstrom X-ray structure of the human heart fatty acid-binding protein complexed with undecanoic acid
To Be Published

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