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7AQS
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BU of 7aqs by Molmil
Crystal structure of E. coli DPS in space group P1
Descriptor: DNA protection during starvation protein, FE (III) ION
Authors:Jakob, R.P, Pipercevic, J, Righetto, R, Goldie, K, Stahlberg, H, Maier, T, Hiller, S.
Deposit date:2020-10-22
Release date:2021-09-01
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Identification of a Dps contamination in Mitomycin-C-induced expression of Colicin Ia.
Biochim Biophys Acta Biomembr, 1863, 2021
1Q7C
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BU of 1q7c by Molmil
The structure of betaketoacyl-[ACP] reductase Y151F mutant in complex with NADPH fragment
Descriptor: 3-oxoacyl-[acyl-carrier protein] reductase, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
Authors:Price, A.C, Zhang, Y.-M, Rock, C.O, White, S.M.
Deposit date:2003-08-17
Release date:2004-02-17
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Cofactor-Induced Conformational Rearrangements Establish a Catalytically Competent Active Site and a Proton Relay Conduit in FabG
Structure, 12, 2004
7AWI
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BU of 7awi by Molmil
Crystal structure of human butyrylcholinesterase in complex with tert-butyl 3-(((2-((1-benzyl-1H-indol-4-yl)oxy)ethyl)amino)methyl]piperidine-1-carboxylate
Descriptor: 2-((1-benzyl-1H-indol-4-yl)oxy)-N-((1-(tert-butoxycarbonyl)piperidin-3-yl)methyl)ethan-1-aminium, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, 2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:Brazzolotto, X, Goral, I, Wieckowska, A.
Deposit date:2020-11-08
Release date:2021-09-29
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Development and crystallography-aided SAR studies of multifunctional BuChE inhibitors and 5-HT 6 R antagonists with beta-amyloid anti-aggregation properties.
Eur.J.Med.Chem., 225, 2021
1Q7T
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BU of 1q7t by Molmil
Rv1170 (MshB) from Mycobacterium tuberculosis
Descriptor: SULFATE ION, hypothetical protein Rv1170, octyl beta-D-glucopyranoside
Authors:McCarthy, A.A, Peterson, N.A, Knijff, R, Baker, E.N, TB Structural Genomics Consortium (TBSGC)
Deposit date:2003-08-20
Release date:2004-01-13
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Crystal Structure of MshB from Mycobacterium tuberculosis, a Deacetylase Involved in Mycothiol Biosynthesis.
J.Mol.Biol., 335, 2004
7AWG
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BU of 7awg by Molmil
Crystal structure of human butyrylcholinesterase in complex with (2-((1-(benzenesulfonyl)-1H-indol-4-yl)oxy)ethyl)(benzyl)amine
Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:Brazzolotto, X, Wichur, T, Wieckowska, A.
Deposit date:2020-11-08
Release date:2021-09-29
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2 Å)
Cite:Development and crystallography-aided SAR studies of multifunctional BuChE inhibitors and 5-HT 6 R antagonists with beta-amyloid anti-aggregation properties.
Eur.J.Med.Chem., 225, 2021
7AMV
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BU of 7amv by Molmil
Atomic structure of the poxvirus transcription pre-initiation complex in the initially melted state
Descriptor: ATP-dependent helicase VETFS, DNA-directed RNA polymerase, DNA-directed RNA polymerase 147 kDa polypeptide, ...
Authors:Grimm, C, Bartuli, J, Fischer, U.
Deposit date:2020-10-09
Release date:2021-10-06
Last modified:2021-10-20
Method:ELECTRON MICROSCOPY (2.8 Å)
Cite:Structural basis of the complete poxvirus transcription initiation process.
Nat.Struct.Mol.Biol., 28, 2021
7AWH
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BU of 7awh by Molmil
Crystal structure of human butyrylcholinesterase in complex with tert-butyl 3-(((2-((1-(benzenesulfonyl)-1H-indol-4-yl)oxy)ethyl)amino)methyl)piperidine-1-carboxylate
Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:Brazzolotto, X, Wichur, T, Wieckowska, A.
Deposit date:2020-11-08
Release date:2021-09-29
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Development and crystallography-aided SAR studies of multifunctional BuChE inhibitors and 5-HT 6 R antagonists with beta-amyloid anti-aggregation properties.
Eur.J.Med.Chem., 225, 2021
7B15
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BU of 7b15 by Molmil
14-3-3sigma in complex with SHN3pT869 phosphopeptide crystal structure
Descriptor: 14-3-3 protein sigma, MAGNESIUM ION, SHN3pT869
Authors:Soini, L, Leysen, S, Davis, J, Ottmann, C.
Deposit date:2020-11-23
Release date:2021-09-29
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.59 Å)
Cite:14-3-3 sigma in complex with phosphopeptides
To Be Published
7B13
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BU of 7b13 by Molmil
14-3-3sigma in complex with SHN3pS542 phosphopeptide crystal structure
Descriptor: 14-3-3 protein sigma, MAGNESIUM ION, SHN3pS542
Authors:Soini, L, Leysen, S, Davis, J, Ottmann, C.
Deposit date:2020-11-23
Release date:2021-09-29
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.37 Å)
Cite:14-3-3 sigma in complex with phosphopeptides
To Be Published
7B1O
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BU of 7b1o by Molmil
Crystal structure of the indoleamine 2,3-dioxygenase 1 (IDO1) in complex with compound 22
Descriptor: 4-chloranyl-N-[(1R)-1-[(1S,5R)-3-quinolin-4-yloxy-6-bicyclo[3.1.0]hexanyl]propyl]benzamide, Indoleamine 2,3-dioxygenase 1
Authors:Lammens, A, Krapp, S, Lewis, R.T, Hamilton, M.M.
Deposit date:2020-11-25
Release date:2021-09-29
Method:X-RAY DIFFRACTION (2.58 Å)
Cite:Discovery of IACS-9779 and IACS-70465 as Potent Inhibitors Targeting Indoleamine 2,3-Dioxygenase 1 (IDO1) Apoenzyme.
J.Med.Chem., 64, 2021
7ATH
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BU of 7ath by Molmil
Crystal structure of UipA
Descriptor: UipA, ZINC ION
Authors:Bremond, N, Gallois, N, Legrand, P, Chapon, V, Arnoux, P.
Deposit date:2020-10-30
Release date:2021-10-06
Last modified:2024-06-19
Method:X-RAY DIFFRACTION (2.343 Å)
Cite:Discovery and characterization of UipA, a uranium- and iron-binding PepSY protein involved in uranium tolerance by soil bacteria.
Isme J, 16, 2022
1QJA
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BU of 1qja by Molmil
14-3-3 ZETA/PHOSPHOPEPTIDE COMPLEX (MODE 2)
Descriptor: 14-3-3 PROTEIN ZETA, PHOSPHOPEPTIDE
Authors:Rittinger, K, Budman, J, Xu, J, Volinia, S, Cantley, L.C, Smerdon, S.J, Gamblin, S.J, Yaffe, M.B.
Deposit date:1999-06-23
Release date:1999-09-15
Last modified:2024-05-01
Method:X-RAY DIFFRACTION (2 Å)
Cite:Structural Analysis of 14-3-3 Phosphopeptide Complexes Identifies a Dual Role for the Nuclear Export Signal of 14-3-3 in Ligand Binding
Mol.Cell, 4, 1999
1QE3
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BU of 1qe3 by Molmil
PNB ESTERASE
Descriptor: PARA-NITROBENZYL ESTERASE, SULFATE ION, ZINC ION
Authors:Spiller, B, Gershenson, A, Arnold, F, Stevens, R.
Deposit date:1999-07-12
Release date:1999-07-21
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:A structural view of evolutionary divergence.
Proc.Natl.Acad.Sci.USA, 96, 1999
5BUM
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BU of 5bum by Molmil
Crystal Structure of LysM domain from Equisetum arvense chitinase A
Descriptor: Chitinase A, SULFATE ION
Authors:Kitaoku, Y, Numata, T, Ohnuma, T, Taira, T, Fukamizo, T.
Deposit date:2015-06-04
Release date:2016-06-08
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structure, mechanism, and phylogeny of LysM-chitinase conjugates specifically found in fern plants.
Plant Sci., 321, 2022
7ATK
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BU of 7atk by Molmil
Crystal structure of UipA in complex with Uranium
Descriptor: URANIUM ATOM, UipA, ZINC ION
Authors:Bremond, N, Gallois, N, Legrand, P, Chapon, V, Arnoux, P.
Deposit date:2020-10-30
Release date:2021-10-06
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.855 Å)
Cite:Discovery and characterization of UipA, a uranium- and iron-binding PepSY protein involved in uranium tolerance by soil bacteria.
Isme J, 16, 2022
5BRO
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BU of 5bro by Molmil
Crystal structure of modified HexB (modB)
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Beta-hexosaminidase subunit beta, FORMIC ACID, ...
Authors:Kitakaze, K, Maita, N, Itoh, K.
Deposit date:2015-06-01
Release date:2016-05-04
Last modified:2020-07-29
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Protease-resistant modified human beta-hexosaminidase B ameliorates symptoms in GM2 gangliosidosis model.
J.Clin.Invest., 126, 2016
5B6C
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BU of 5b6c by Molmil
Structural Details of Ufd1 binding to p97
Descriptor: Peptide from Ubiquitin fusion degradation protein 1 homolog, Transitional endoplasmic reticulum ATPase
Authors:Le, L.T.M, Yang, J.K.
Deposit date:2016-05-26
Release date:2017-01-04
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Structural Details of Ufd1 Binding to p97 and Their Functional Implications in ER-Associated Degradation
PLoS ONE, 11, 2016
6G51
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BU of 6g51 by Molmil
Cryo-EM structure of a late human pre-40S ribosomal subunit - State D
Descriptor: 18S ribosomal RNA, 40S ribosomal protein S10, 40S ribosomal protein S11, ...
Authors:Ameismeier, M, Cheng, J, Berninghausen, O, Beckmann, R.
Deposit date:2018-03-28
Release date:2018-06-06
Last modified:2024-05-15
Method:ELECTRON MICROSCOPY (4.1 Å)
Cite:Visualizing late states of human 40S ribosomal subunit maturation.
Nature, 558, 2018
5BCA
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BU of 5bca by Molmil
BETA-AMYLASE FROM BACILLUS CEREUS VAR. MYCOIDES
Descriptor: CALCIUM ION, PROTEIN (1,4-ALPHA-D-GLUCAN MALTOHYDROLASE.)
Authors:Oyama, T, Kusunoki, M, Kishimoto, Y, Takasaki, Y, Nitta, Y.
Deposit date:1999-03-12
Release date:2000-03-15
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Crystal structure of beta-amylase from Bacillus cereus var. mycoides at 2.2 A resolution.
J.Biochem.(Tokyo), 125, 1999
5BKA
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BU of 5bka by Molmil
2.1 Angstrom structure of ActVI-ORFA from Streptomyces Coelicolor
Descriptor: Hydroxylacyl-CoA dehydrogenase
Authors:Vuksanovic, N, Silvaggi, N.R.
Deposit date:2019-06-02
Release date:2020-06-03
Last modified:2020-09-02
Method:X-RAY DIFFRACTION (2.11 Å)
Cite:Structural characterization of three noncanonical NTF2-like superfamily proteins: implications for polyketide biosynthesis.
Acta Crystallogr.,Sect.F, 76, 2020
7B5A
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BU of 7b5a by Molmil
X-ray crystal structure of Sporosarcina pasteurii urease inhibited by Ag(PEt3)2NO3 determined at 1.97 Angstroms
Descriptor: 1,2-ETHANEDIOL, NICKEL (II) ION, OXYGEN ATOM, ...
Authors:Mazzei, L, Cianci, M, Ciurli, S.
Deposit date:2020-12-03
Release date:2021-10-13
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.97 Å)
Cite:Kinetic and structural analysis of the inactivation of urease by mixed-ligand phosphine halide Ag(I) complexes.
J.Inorg.Biochem., 218, 2021
7B58
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BU of 7b58 by Molmil
X-ray crystal structure of Sporosarcina pasteurii urease inhibited by Ag(PEt3)Cl determined at 1.72 Angstroms
Descriptor: 1,2-ETHANEDIOL, NICKEL (II) ION, OXYGEN ATOM, ...
Authors:Mazzei, L, Cianci, M, Ciurli, S.
Deposit date:2020-12-03
Release date:2021-10-13
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.72 Å)
Cite:Kinetic and structural analysis of the inactivation of urease by mixed-ligand phosphine halide Ag(I) complexes.
J.Inorg.Biochem., 218, 2021
7AYX
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BU of 7ayx by Molmil
Structure of the cytochrome P450 AryC from Streptomyces roseosporus NRRL 15998
Descriptor: Cytochrome P450 113A1, PROTOPORPHYRIN IX CONTAINING FE, SULFATE ION
Authors:Schneider, S, Schaefers, F, Gulder, T.A.M.
Deposit date:2020-11-13
Release date:2021-10-27
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.53 Å)
Cite:Carrier Protein-Free Enzymatic Biaryl Coupling in Arylomycin A2 Assembly and Structure of the Cytochrome P450 AryC.
Chemistry, 28, 2022
7B59
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BU of 7b59 by Molmil
X-ray crystal structure of Sporosarcina pasteurii urease inhibited by Ag(PEt3)Br determined at 1.63 Angstroms
Descriptor: 1,2-ETHANEDIOL, NICKEL (II) ION, OXYGEN ATOM, ...
Authors:Mazzei, L, Cianci, M, Ciurli, S.
Deposit date:2020-12-03
Release date:2021-10-13
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.63 Å)
Cite:Kinetic and structural analysis of the inactivation of urease by mixed-ligand phosphine halide Ag(I) complexes.
J.Inorg.Biochem., 218, 2021
7B0Z
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BU of 7b0z by Molmil
Crystal Structure of human monoamine oxidase B in complex with (E)-3-phenyl-1-(4-(trifluoromethyl)phenyl)prop-2-en-1-one
Descriptor: (E)-3-phenyl-1-(4-(trifluoromethyl)phenyl)prop-2-en-1-one, Amine oxidase [flavin-containing] B, FLAVIN-ADENINE DINUCLEOTIDE, ...
Authors:Iacovino, L.G, Binda, C.
Deposit date:2020-11-23
Release date:2021-11-03
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Promising Non-cytotoxic Monosubstituted Chalcones to Target Monoamine Oxidase-B.
Acs Med.Chem.Lett., 12, 2021

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