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3KWX
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BU of 3kwx by Molmil
Chemically modified Taka alpha-amylase
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, Alpha-amylase A type-1/2, CALCIUM ION
Authors:Siddiqui, K.S, Harrop, S.J, Poljak, A, De Francisci, D, Guerriero, G, Pilak, O, Burg, D, Raftery, M.J, Parkin, D.M, Trewhella, J, Cavicchioli, R.
Deposit date:2009-12-01
Release date:2009-12-29
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:A Modified alpha-amylase with a molten-globule state has enhanced thermal stability
To be Published
3L1L
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BU of 3l1l by Molmil
Structure of Arg-bound Escherichia coli AdiC
Descriptor: ARGININE, Arginine/agmatine antiporter, nonyl beta-D-glucopyranoside
Authors:Gao, X, Zhou, L, Shi, Y.
Deposit date:2009-12-13
Release date:2010-02-02
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (3.002 Å)
Cite:Mechanism of substrate recognition and transport by an amino acid antiporter
Nature, 463, 2010
4DNC
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BU of 4dnc by Molmil
Crystal structure of human MOF in complex with MSL1
Descriptor: Histone acetyltransferase KAT8, Male-specific lethal 1 homolog, ZINC ION
Authors:Huang, J, Lei, M.
Deposit date:2012-02-08
Release date:2012-07-25
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (2.05 Å)
Cite:Structural insight into the regulation of MOF in the male-specific lethal complex and the non-specific lethal complex.
Cell Res., 22, 2012
4DNT
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BU of 4dnt by Molmil
Crystal structure of the CusBA heavy-metal efflux complex from Escherichia coli, mutant
Descriptor: Cation efflux system protein CusA, Cation efflux system protein CusB
Authors:Su, C.-C, Long, F, Yu, E.
Deposit date:2012-02-09
Release date:2012-06-20
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (3.1 Å)
Cite:Charged Amino Acids (R83, E567, D617, E625, R669, and K678) of CusA Are Required for Metal Ion Transport in the Cus Efflux System.
J.Mol.Biol., 422, 2012
3L06
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BU of 3l06 by Molmil
Crystal structure of N-acetyl-L-ornithine transcarbamylase E92V mutant complexed with carbamyl phosphate and N-succinyl-L-norvaline
Descriptor: N-(3-CARBOXYPROPANOYL)-L-NORVALINE, N-acetylornithine carbamoyltransferase, PHOSPHORIC ACID MONO(FORMAMIDE)ESTER, ...
Authors:Shi, D, Yu, X, Allewell, N.M, Tuchman, M.
Deposit date:2009-12-09
Release date:2010-03-31
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.81 Å)
Cite:A single mutation in the active site swaps the substrate specificity of N-acetyl-L-ornithine transcarbamylase and N-succinyl-L-ornithine transcarbamylase.
Protein Sci., 16, 2007
3F5Q
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BU of 3f5q by Molmil
CRYSTAL STRUCTURE OF putative short chain dehydrogenase from Escherichia coli CFT073
Descriptor: dehydrogenase
Authors:Malashkevich, V.N, Toro, R, Sauder, J.M, Burley, S.K, Almo, S.C, New York SGX Research Center for Structural Genomics (NYSGXRC)
Deposit date:2008-11-04
Release date:2009-01-13
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (1.76 Å)
Cite:Crystal structure of an uncharacterized protein
to be published
4DOY
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BU of 4doy by Molmil
Crystal structure of Dibenzothiophene desulfurization enzyme C
Descriptor: Dibenzothiophene desulfurization enzyme C, GLYCEROL
Authors:Liu, S, Zhang, C, Zhu, D, Gu, L.
Deposit date:2012-02-12
Release date:2013-02-13
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (1.789 Å)
Cite:Crystal structure of DszC from Rhodococcus sp. XP at 1.79 angstrom
Proteins, 82, 2014
3L4K
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BU of 3l4k by Molmil
Topoisomerase II-DNA cleavage complex, metal-bound
Descriptor: 3'-THIO-THYMIDINE-5'-PHOSPHATE, DNA (5'-D(*CP*GP*CP*GP*AP*AP*TP*CP*GP*TP*CP*AP*TP*CP*C)-3'), DNA (5'-D(*CP*GP*CP*GP*GP*TP*AP*GP*CP*AP*GP*TP*AP*GP*G)-3'), ...
Authors:Schmidt, B.H, Burgin, A.B, Deweese, J.E, Osheroff, N, Berger, J.M.
Deposit date:2009-12-20
Release date:2010-05-26
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (2.98 Å)
Cite:A novel and unified two-metal mechanism for DNA cleavage by type II and IA topoisomerases.
Nature, 465, 2010
3TXT
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BU of 3txt by Molmil
Crystal structure of GlpG in complex with inhibitor DFP
Descriptor: DIISOPROPYL PHOSPHONATE, Rhomboid protease glpG
Authors:Xue, Y, Ha, Y.
Deposit date:2011-09-23
Release date:2011-12-07
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:The crystal structure of rhomboid protease GlpG in complex with a mechanism-based inhibitor
To be Published
3FKG
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BU of 3fkg by Molmil
Crystal Structure Analysis of Fungal Versatile Peroxidase from Pleurotus eryngii
Descriptor: CACODYLATE ION, CALCIUM ION, FE (III) ION, ...
Authors:Piontek, K, Martinez, A.T, Choinowski, T, Plattner, D.A.
Deposit date:2008-12-16
Release date:2009-12-22
Last modified:2024-10-09
Method:X-RAY DIFFRACTION (1.81 Å)
Cite:Structural and Site-directed Mutagenesis Study of Versatile Peroxidase Oxidizing both Mn(II) and Aromatic Substrates
To be Published
4F5H
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BU of 4f5h by Molmil
Intercoversion of Substrate Specificity: E. coli Aspatate Aminotransferase to Tyrosine Aminotransferase: Chimera P3.
Descriptor: Aspartate aminotransferase
Authors:Addington, T.A, Fisher, A.J, Toney, M.D.
Deposit date:2012-05-13
Release date:2013-02-13
Last modified:2013-04-24
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Janus: prediction and ranking of mutations required for functional interconversion of enzymes.
J.Mol.Biol., 425, 2013
3KSS
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BU of 3kss by Molmil
Structure and Mechanism of the Heavy Metal Transporter CusA
Descriptor: COPPER (I) ION, Cation efflux system protein cusA
Authors:Su, C.-C.
Deposit date:2009-11-23
Release date:2010-09-22
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (3.88 Å)
Cite:Crystal structures of the CusA efflux pump suggest methionine-mediated metal transport.
Nature, 467, 2010
3KSQ
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BU of 3ksq by Molmil
Discovery of C-Imidazole Azaheptapyridine FPT Inhibitors
Descriptor: FARNESYL DIPHOSPHATE, Farnesyltransferase, CAAX box, ...
Authors:Zhu, H.Y, Cooper, A.B, Njoroge, G, Kirschmeier, P, Strickland, C, Hruza, A, Girijavallabhan, V.M.
Deposit date:2009-11-23
Release date:2010-01-26
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Discovery of C-imidazole azaheptapyridine FPT inhibitors.
Bioorg.Med.Chem.Lett., 20, 2010
3FH6
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BU of 3fh6 by Molmil
Crystal structure of the resting state maltose transporter from E. coli
Descriptor: Maltose transport system permease protein malF, Maltose transport system permease protein malG, Maltose/maltodextrin import ATP-binding protein malK
Authors:Khare, D, Oldham, M.L, Orelle, C, Davidson, A.L, Chen, J.
Deposit date:2008-12-08
Release date:2009-03-03
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (4.5 Å)
Cite:Alternating access in maltose transporter mediated by rigid-body rotations.
Mol.Cell, 33, 2009
4FAM
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BU of 4fam by Molmil
Crystal structure of human 17beta-hydroxysteroid dehydrogenase type 5 in complex with 3-((3,4-dihydroisoquinolin-2(1H)-yl)sulfonyl)benzoic acid (17)
Descriptor: 1,2-ETHANEDIOL, 3-(3,4-dihydroisoquinolin-2(1H)-ylsulfonyl)benzoic acid, Aldo-keto reductase family 1 member C3, ...
Authors:Turnbull, A.P, Jamieson, S.M.F, Brooke, D.G, Heinrich, D, Atwell, G.J, Silva, S, Hamilton, E.J, Rigoreau, L.J.M, Trivier, E, Soudy, C, Samlal, S.S, Owen, P.J, Schroeder, E, Raynham, T, Flanagan, J.U, Denny, W.A.
Deposit date:2012-05-22
Release date:2012-10-10
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2 Å)
Cite:3-(3,4-Dihydroisoquinolin-2(1H)-ylsulfonyl)benzoic acids; a New Class of Highly Potent and Selective Inhibitors of the Type 5 17-beta-hydroxysteroid Dehydrogenase AKR1C3
J.Med.Chem., 55, 2012
3FOU
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BU of 3fou by Molmil
Low pH structure of the Rieske protein from Thermus thermophilus at 2.1 A
Descriptor: ACETATE ION, CALCIUM ION, FE2/S2 (INORGANIC) CLUSTER, ...
Authors:Hunsicker-Wang, L.M, Taylor, A.B.
Deposit date:2009-01-02
Release date:2009-10-20
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Effects of pH on the Rieske Protein from Thermus thermophilus: A Spectroscopic and Structural Analysis
Biochemistry, 48, 2009
3KXO
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BU of 3kxo by Molmil
An orally active inhibitor bound at the active site of HPGDS
Descriptor: 6-(3-fluorophenyl)-N-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]pyridine-3-carboxamide, GLUTATHIONE, Glutathione-requiring prostaglandin D synthase, ...
Authors:Kiefer, J.R, Day, J.E, Thorarensen, A.
Deposit date:2009-12-03
Release date:2010-09-01
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Discovery of an oral potent selective inhibitor of hematopoietic prostaglandin D synthase
TO BE PUBLISHED
3U3L
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BU of 3u3l by Molmil
Crystal structure of the selenomethionine derivative of tablysin-15
Descriptor: CITRIC ACID, PALMITIC ACID, PRASEODYMIUM ION, ...
Authors:Andersen, J.F, Xu, X, Ribeiro, J.M.
Deposit date:2011-10-06
Release date:2012-02-15
Last modified:2017-11-08
Method:X-RAY DIFFRACTION (1.57 Å)
Cite:Structure of protein having inhibitory disintegrin and leukotriene scavenging functions contained in single domain.
J.Biol.Chem., 287, 2012
3U8X
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BU of 3u8x by Molmil
Crystal Structure of a chimera containing the N-terminal domain (residues 8-29) of drosophila Ciboulot and the C-terminal domain (residues 18-44) of bovine Thymosin-beta4, bound to G-actin-ATP
Descriptor: ADENOSINE-5'-TRIPHOSPHATE, Actin, alpha skeletal muscle, ...
Authors:Renault, L, Husson, C, Carlier, M.F, Didry, D.
Deposit date:2011-10-17
Release date:2012-01-25
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2 Å)
Cite:How a single residue in individual beta-thymosin/WH2 domains controls their functions in actin assembly
Embo J., 31, 2012
4EZU
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BU of 4ezu by Molmil
Crystal structure of the substrate binding domain of E.coli DnaK in complex with PR-bombesin in space group I222
Descriptor: Chaperone protein DnaK, Proline rich bombesin-related protein
Authors:Zahn, M, Straeter, N.
Deposit date:2012-05-03
Release date:2013-04-24
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Structural studies of DnaK in complex with proline rich antimicrobial peptides reveal two different peptide binding modes
To be Published
3F5L
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BU of 3f5l by Molmil
Semi-active E176Q mutant of rice BGlu1, a plant exoglucanase/beta-glucosidase
Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, Beta-glucosidase, SULFATE ION, ...
Authors:Chuenchor, W, Ketudat Cairns, J.R, Pengthaisong, S, Robinson, R.C, Yuvaniyama, J, Chen, C.-J.
Deposit date:2008-11-04
Release date:2009-11-03
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (1.37 Å)
Cite:The structural basis of oligosaccharide binding by rice BGlu1 beta-glucosidase
J.Struct.Biol., 173, 2011
4F1H
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BU of 4f1h by Molmil
Crystal structure of TDP2 from Danio rerio complexed with a single strand DNA
Descriptor: DNA (5'-D(P*TP*GP*CP*AP*G)-3'), GLYCEROL, MAGNESIUM ION, ...
Authors:Shi, K, Kurahashi, K, Aihara, H.
Deposit date:2012-05-06
Release date:2012-10-31
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.662 Å)
Cite:Structural basis for recognition of 5'-phosphotyrosine adducts by Tdp2.
Nat.Struct.Mol.Biol., 19, 2012
3F92
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BU of 3f92 by Molmil
Crystal structure of ubiquitin-conjugating enzyme E2-25kDa (Huntington Interacting Protein 2) M172A mutant crystallized at pH 8.5
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, BETA-MERCAPTOETHANOL, CALCIUM ION, ...
Authors:Wilson, R.C, Hughes, R.C, Flatt, J.W, Meehan, E.J, Ng, J.D, Twigg, P.D.
Deposit date:2008-11-13
Release date:2008-11-25
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.23 Å)
Cite:Structure of full-length ubiquitin-conjugating enzyme E2-25K (huntingtin-interacting protein 2).
Acta Crystallogr.,Sect.F, 65, 2009
4F5L
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BU of 4f5l by Molmil
A Theoretical Optimized Mutant for the Conversion of Substrate Specificity and Activity of Aspartate Aminotransferase to Tyrosine Aminotransferase: Chimera P7.
Descriptor: 1,2-ETHANEDIOL, Aspartate aminotransferase
Authors:Addington, T.A, Fisher, A.J, Toney, M.D.
Deposit date:2012-05-13
Release date:2013-05-15
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Janus: an algorithm for ranking functional importance of residues from protein sequence alignments.
To be Published
3R7M
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BU of 3r7m by Molmil
AKR1C3 complex with sulindac
Descriptor: 1,2-ETHANEDIOL, Aldo-keto reductase family 1 member C3, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
Authors:Yosaatmadja, Y, Teague, R.M, Flanagan, J.U, Squire, C.J.
Deposit date:2011-03-22
Release date:2012-05-02
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Crystal structures of three classes of non-steroidal anti-inflammatory drugs in complex with aldo-keto reductase 1C3.
Plos One, 7, 2012

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PDB entries from 2024-11-13

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