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4UAG
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BU of 4uag by Molmil
UDP-N-ACETYLMURAMOYL-L-ALANINE:D-GLUTAMATE LIGASE
Descriptor: SULFATE ION, UDP-N-ACETYLMURAMOYL-L-ALANINE:D-GLUTAMATE LIGASE, UNKNOWN ATOM OR ION, ...
Authors:Bertrand, J, Auger, G, Martin, L, Fanchon, E, Blanot, D, Le Beller, D, Van Heijenoort, J, Dideberg, O.
Deposit date:1999-03-09
Release date:2000-03-15
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (1.66 Å)
Cite:Determination of the MurD mechanism through crystallographic analysis of enzyme complexes.
J.Mol.Biol., 289, 1999
3LK0
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BU of 3lk0 by Molmil
X-ray structure of bovine SC0067,Ca(2+)-S100B
Descriptor: 3-(2-chloro-10H-phenothiazin-10-yl)-N,N-dimethylpropan-1-amine, CALCIUM ION, Protein S100-B
Authors:Charpentier, T.H, Weber, D.J, Wilder, P.W.
Deposit date:2010-01-26
Release date:2010-12-29
Last modified:2024-05-22
Method:X-RAY DIFFRACTION (2.04 Å)
Cite:In vitro screening and structural characterization of inhibitors of the S100B-p53 interaction.
Int J High Throughput Screen, 2010, 2010
8HYB
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BU of 8hyb by Molmil
Crystal structure of B1 IMP-1 MBL in complex with 2-amino-5-phenethylthiazole-4-carboxylic acid
Descriptor: 2-azanyl-5-(2-phenylethyl)-1,3-thiazole-4-carboxylic acid, ACETATE ION, Beta-lactamase, ...
Authors:Yan, Y.-H, Zhu, K.-R, Li, G.-B.
Deposit date:2023-01-06
Release date:2024-01-24
Method:X-RAY DIFFRACTION (2.193 Å)
Cite:2-Aminothiazole-4-carboxylic acids as cross-class metallo-beta-lactamase inhibitors by mimicking beta-lactam hydrolysate binding
To Be Published
1A6L
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BU of 1a6l by Molmil
T14C MUTANT OF AZOTOBACTER VINELANDII FDI
Descriptor: FE3-S4 CLUSTER, FERREDOXIN, IRON/SULFUR CLUSTER
Authors:Gao-Sheridan, H.S, Kemper, M.A, Khayat, R, Armstrong, F.A, Prasad, G.S, Sridhar, V, Stout, C.D, Burgess, B.K.
Deposit date:1998-02-26
Release date:1998-05-27
Last modified:2024-05-22
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:A T14C variant of Azotobacter vinelandii ferredoxin I undergoes facile [3Fe-4S]0 to [4Fe-4S]2+ conversion in vitro but not in vivo.
J.Biol.Chem., 273, 1998
8HYC
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BU of 8hyc by Molmil
Crystal structure of B1 NDM-1 MBL in complex with 2-amino-5-(2-(thiophen-2-yl)ethyl)thiazole-4-carboxylic acid
Descriptor: 2-azanyl-5-(2-thiophen-2-ylethyl)-1,3-thiazole-4-carboxylic acid, Metallo-beta-lactamase type 2, ZINC ION
Authors:Yan, Y.-H, Zhu, K.-R, Li, G.-B.
Deposit date:2023-01-06
Release date:2024-06-19
Method:X-RAY DIFFRACTION (1.151 Å)
Cite:2-Aminothiazole-4-carboxylic acids as cross-class metallo-beta-lactamase inhibitors by mimicking beta-lactam hydrolysate binding
To Be Published
7ZOK
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BU of 7zok by Molmil
Solution structure of GltJ ZnR domain from Myxococcus xanthus
Descriptor: Adventurous gliding motility protein X, ZINC ION
Authors:Attia, B, My, L, Castaing, J.P, Le Guenno, H, Espinosa, L, Schmidt, V, Nouailler, M, Bornet, O, Mignot, T, Elantak, L.
Deposit date:2022-04-25
Release date:2023-02-22
Last modified:2024-09-04
Method:SOLUTION NMR
Cite:A molecular switch controls assembly of bacterial focal adhesions.
Sci Adv, 10, 2024
8IOZ
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BU of 8ioz by Molmil
Crystal structure of transaminase
Descriptor: Branched chain amino acid: 2-keto-4-methylthiobutyrate aminotransferase
Authors:Li, Q, Zhu, Y.M, Gao, J, Wei, H.L, Han, X, Liu, W.D, Sun, Y.X.
Deposit date:2023-03-13
Release date:2024-01-24
Method:X-RAY DIFFRACTION (2.33 Å)
Cite:structure of aminotransferase
To Be Published
8I83
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BU of 8i83 by Molmil
Crystal Structure of phosphinothricin dehydrogenase
Descriptor: 1,2-ETHANEDIOL, Glutamate dehydrogenase
Authors:Cheng, F, Xue, Y.P, Zheng, Y.G, Zou, S.P.
Deposit date:2023-02-03
Release date:2024-02-14
Method:X-RAY DIFFRACTION (2.62 Å)
Cite:Crystal Structure of phosphinothricin dehydrogenase
To Be Published
2W0H
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BU of 2w0h by Molmil
X ray structure of Leishmania infantum Trypanothione reductase in complex with antimony and NADPH
Descriptor: ANTIMONY (III) ION, FLAVIN-ADENINE DINUCLEOTIDE, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
Authors:Baiocco, P, Colotti, G, Franceschini, S, Ilari, A.
Deposit date:2008-08-18
Release date:2009-04-28
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (3 Å)
Cite:Molecular Basis of Antimony Treatment in Leishmaniasis.
J.Med.Chem., 52, 2009
2WFL
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BU of 2wfl by Molmil
Crystal structure of polyneuridine aldehyde esterase
Descriptor: POLYNEURIDINE-ALDEHYDE ESTERASE, SULFATE ION
Authors:Yang, L, Hill, M, Panjikar, S, Wang, M, Stoeckigt, J.
Deposit date:2009-04-08
Release date:2009-08-18
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Structural Basis and Enzymatic Mechanism of the Biosynthesis of C9- from C10-Monoterpenoid Indole Alkaloids.
Angew.Chem.Int.Ed.Engl., 48, 2009
4UAB
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BU of 4uab by Molmil
Crystal structure of a TRAP periplasmic solute binding protein from Chromohalobacter salexigens DSM 3043 (Csal_0678), Target EFI-501078, with bound ethanolamine
Descriptor: CHLORIDE ION, ETHANOLAMINE, Twin-arginine translocation pathway signal
Authors:Vetting, M.W, Al Obaidi, N.F, Morisco, L.L, Wasserman, S.R, Sojitra, S, Stead, M, Attonito, J.D, Scott Glenn, A, Chowdhury, S, Evans, B, Hillerich, B, Love, J, Seidel, R.D, Imker, H.J, Gerlt, J.A, Almo, S.C, Enzyme Function Initiative (EFI)
Deposit date:2014-08-08
Release date:2014-09-03
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Experimental strategies for functional annotation and metabolism discovery: targeted screening of solute binding proteins and unbiased panning of metabolomes.
Biochemistry, 54, 2015
7NWA
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BU of 7nwa by Molmil
CRYSTAL STRUCTURE OF HUMAN CYTOSOLIC BRANCHED-CHAIN AMINOTRANSFERASE (BCAT1) IN COMPLEX WITH PLP AND COMPOUND A
Descriptor: 2-[[4-chloranyl-2,6-bis(fluoranyl)phenyl]methylamino]-7-oxidanylidene-5-propyl-4H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile, Branched-chain-amino-acid aminotransferase, cytosolic, ...
Authors:Hillig, R.C.
Deposit date:2021-03-16
Release date:2022-11-02
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.59 Å)
Cite:BAY-069, a Novel (Trifluoromethyl)pyrimidinedione-Based BCAT1/2 Inhibitor and Chemical Probe.
J.Med.Chem., 65, 2022
7OR3
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BU of 7or3 by Molmil
Ternary complex of 14-3-3 sigma, NotchpS1917 phosphopeptide, and WQ136
Descriptor: 14-3-3 protein sigma, CHLORIDE ION, MAGNESIUM ION, ...
Authors:Centorrino, F, Wu, Q, Ottmann, C.
Deposit date:2021-06-04
Release date:2022-06-22
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:A crystallography-based study of fragment extensions into the 14-3-3 binding groove
To Be Published
7OR5
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BU of 7or5 by Molmil
Ternary complex of 14-3-3 sigma, NotchpS1917 phosphopeptide, and WQ162
Descriptor: 14-3-3 protein sigma, CHLORIDE ION, Neurogenic locus notch homolog protein 4, ...
Authors:Centorrino, F, Wu, Q, Ottmann, C.
Deposit date:2021-06-04
Release date:2022-07-20
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:A crystallography-based study of fragment extensions into the 14-3-3 binding groove
To Be Published
7OR7
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BU of 7or7 by Molmil
Ternary complex of 14-3-3 sigma, NotchpS1917 phosphopeptide, and WQ178
Descriptor: 14-3-3 protein sigma, CHLORIDE ION, MAGNESIUM ION, ...
Authors:Centorrino, F, Wu, Q, Ottmann, C.
Deposit date:2021-06-04
Release date:2022-07-20
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:A crystallography-based study of fragment extensions into the 14-3-3 binding groove
To Be Published
1ETE
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BU of 1ete by Molmil
CRYSTAL STRUCTURE OF THE FLT3 LIGAND
Descriptor: FLT3 LIGAND, ZINC ION
Authors:Savvides, S.N, Boone, T, Karplus, P.A.
Deposit date:2000-04-12
Release date:2000-06-14
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Flt3 ligand structure and unexpected commonalities of helical bundles and cystine knots.
Nat.Struct.Biol., 7, 2000
4V4N
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BU of 4v4n by Molmil
Structure of the Methanococcus jannaschii ribosome-SecYEBeta channel complex
Descriptor: 16S ribosomal RNA, 23S ribosomal RNA, 30S ribosomal protein L7AE, ...
Authors:Menetret, J.F, Park, E, Gumbart, J.C, Ludtke, S.J, Li, W, Whynot, A, Rapoport, T.A, Akey, C.W.
Deposit date:2013-06-17
Release date:2014-07-09
Last modified:2024-02-28
Method:ELECTRON MICROSCOPY (9 Å)
Cite:Structure of the SecY channel during initiation of protein translocation.
Nature, 506, 2013
1E7K
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BU of 1e7k by Molmil
Crystal structure of the spliceosomal 15.5kD protein bound to a U4 snRNA fragment
Descriptor: 15.5 KD RNA BINDING PROTEIN, RNA (5'-R(*GP*CP*CP*AP*AP*UP*GP*AP*GP*GP*UP*UP*UP* AP*UP*CP*CP*GP*AP*GP*G*C(-3')
Authors:Vidovic, I, Nottrott, S, Harthmuth, K, Luhrmann, R, Ficner, R.
Deposit date:2000-08-29
Release date:2001-02-19
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Crystal Structure of the Spliceosomal 15.5Kd Protein Bound to a U4 Snrna Fragment
Mol.Cell, 6, 2000
7PZI
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BU of 7pzi by Molmil
HBc-F97L (premature secretion phenotype) in complex with Triton X-100
Descriptor: Capsid protein, FRAGMENT OF TRITON X-100
Authors:Makbul, C, Boettcher, B.
Deposit date:2021-10-12
Release date:2021-12-08
Last modified:2024-07-17
Method:ELECTRON MICROSCOPY (2.9 Å)
Cite:Binding of a Pocket Factor to Hepatitis B Virus Capsids Changes the Rotamer Conformation of Phenylalanine 97.
Viruses, 13, 2021
7PZL
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BU of 7pzl by Molmil
HBc-F97L premature secretion phenotype
Descriptor: Capsid protein, FRAGMENT OF TRITON X-100
Authors:Makbul, C, Boettcher, B.
Deposit date:2021-10-12
Release date:2021-12-08
Last modified:2024-07-17
Method:ELECTRON MICROSCOPY (2.8 Å)
Cite:Binding of a Pocket Factor to Hepatitis B Virus Capsids Changes the Rotamer Conformation of Phenylalanine 97.
Viruses, 13, 2021
3BWN
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BU of 3bwn by Molmil
L-tryptophan aminotransferase
Descriptor: 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE, L-tryptophan aminotransferase, PHENYLALANINE, ...
Authors:Ferrer, J.-L, Noel, J.P, Pojer, F, Bowman, M, Chory, J, Tao, Y.
Deposit date:2008-01-10
Release date:2008-04-29
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (2.25 Å)
Cite:Rapid synthesis of auxin via a new tryptophan-dependent pathway is required for shade avoidance in plants
Cell(Cambridge,Mass.), 133, 2008
8B1N
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BU of 8b1n by Molmil
Crystal structure of TrmD-Tm1570 from Calditerrivibrio nitroreducens in complex with S-adenosyl-L-methionine
Descriptor: CHLORIDE ION, GLYCEROL, MAGNESIUM ION, ...
Authors:Kluza, A, Lewandowska, I, Augustyniak, R, Sulkowska, J.
Deposit date:2022-09-10
Release date:2022-09-28
Last modified:2024-07-03
Method:X-RAY DIFFRACTION (2 Å)
Cite:Are there double knots in proteins? Prediction and in vitro verification based on TrmD-Tm1570 fusion from C. nitroreducens.
Front Mol Biosci, 10, 2023
8IWC
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BU of 8iwc by Molmil
Crystal structure of Q9PR55 at pH 6.0
Descriptor: Uncharacterized protein UU089.1
Authors:Hsu, M.F, Ko, T.P, Huang, K.F, Chen, Y.R, Huang, J.S, Hsu, S.T.D.
Deposit date:2023-03-29
Release date:2024-02-07
Method:X-RAY DIFFRACTION (2.43 Å)
Cite:Structure, dynamics, and stability of the smallest and most complex 7 1 protein knot.
J.Biol.Chem., 300, 2023
8IWA
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BU of 8iwa by Molmil
Crystal structure of Q9PR55 at pH 6.5
Descriptor: SULFATE ION, Uncharacterized protein UU089.1
Authors:Hsu, M.F, Ko, T.P, Huang, K.F, Chen, Y.R, Huang, J.S, Hsu, S.T.D.
Deposit date:2023-03-29
Release date:2024-02-07
Method:X-RAY DIFFRACTION (2.51 Å)
Cite:Structure, dynamics, and stability of the smallest and most complex 7 1 protein knot.
J.Biol.Chem., 300, 2023
8IWB
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BU of 8iwb by Molmil
Crystal structure of Q9PR55 at pH 7.5
Descriptor: Uncharacterized protein UU089.1
Authors:Hsu, M.F, Ko, T.P, Huang, K.F, Chen, Y.R, Huang, J.S, Hsu, S.T.D.
Deposit date:2023-03-29
Release date:2024-02-07
Method:X-RAY DIFFRACTION (2.42 Å)
Cite:Structure, dynamics, and stability of the smallest and most complex 7 1 protein knot.
J.Biol.Chem., 300, 2023

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