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7KCU
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BU of 7kcu by Molmil
Joint neutron/X-ray structure of Oxyferrous Dehaloperoxidase B
Descriptor: Dehaloperoxidase B, OXYGEN MOLECULE, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Carey, L.M, Ghiladi, R.A, Meilleur, F, Myles, D.
Deposit date:2020-10-07
Release date:2021-10-13
Last modified:2023-10-25
Method:NEUTRON DIFFRACTION (2.2 Å), X-RAY DIFFRACTION
Cite:Complementarity of neutron, XFEL and synchrotron crystallography for defining the structures of metalloenzymes at room temperature.
Iucrj, 9, 2022
7JOR
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BU of 7jor by Molmil
Neutron structure of ferric Dehaloperoxidase B
Descriptor: 2-(2-METHOXYETHOXY)ETHANOL, Dehaloperoxidase B, PROTOPORPHYRIN IX CONTAINING FE
Authors:Carey, L.M, Ghiladi, R.A, Meilleur, F, Myles, D.A.A.
Deposit date:2020-08-07
Release date:2021-09-08
Last modified:2024-04-03
Method:NEUTRON DIFFRACTION (2.05 Å)
Cite:Complementarity of neutron, XFEL and synchrotron crystallography for defining the structures of metalloenzymes at room temperature.
Iucrj, 9, 2022
4OLD
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BU of 4old by Molmil
Crystal structure of AmpC beta-lactamase in complex with the product form of (6R,7R)-7-amino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Descriptor: (2R)-2-[(R)-amino(carboxy)methyl]-3,6-dihydro-2H-1,3-thiazine-4-carboxylic acid, Beta-lactamase, PHOSPHATE ION
Authors:Shoichet, B.K, Barelier, S.
Deposit date:2014-01-23
Release date:2014-05-28
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.48 Å)
Cite:Substrate deconstruction and the nonadditivity of enzyme recognition.
J.Am.Chem.Soc., 136, 2014
7KFM
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BU of 7kfm by Molmil
Room temperature oxyferrous Dehaloperoxidase B
Descriptor: 2-(2-METHOXYETHOXY)ETHANOL, Dehaloperoxidase B, OXYGEN MOLECULE, ...
Authors:Carey, L.M, Ghiladi, R.A.
Deposit date:2020-10-14
Release date:2021-10-20
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Complementarity of neutron, XFEL and synchrotron crystallography for defining the structures of metalloenzymes at room temperature.
Iucrj, 9, 2022
4GN0
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BU of 4gn0 by Molmil
De novo phasing of a Hamp-complex using an improved Arcimboldo method
Descriptor: Hamp domain of AF1503, MAGNESIUM ION
Authors:Hulko, M, Ursinus, A, Bar, K, Martin, J, Zeth, K, Lupas, A.N.
Deposit date:2012-08-16
Release date:2013-09-11
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Exploiting tertiary structure through local folds for crystallographic phasing.
Nat.Methods, 10, 2013
2A1M
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BU of 2a1m by Molmil
Crystal structure of ferrous dioxygen complex of wild-type cytochrome P450cam
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, CAMPHOR, Cytochrome P450-cam, ...
Authors:Nagano, S, Poulos, T.L.
Deposit date:2005-06-20
Release date:2005-07-05
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Crystallographic study on the dioxygen complex of wild-type and mutant cytochrome P450cam. Implications for the dioxygen activation mechanism
J.Biol.Chem., 280, 2005
2A1O
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BU of 2a1o by Molmil
Crystal structure of ferrous dioxygen complex of T252A cytochrome P450cam
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, CAMPHOR, Cytochrome P450-cam, ...
Authors:Nagano, S, Poulos, T.L.
Deposit date:2005-06-20
Release date:2005-07-05
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Crystallographic study on the dioxygen complex of wild-type and mutant cytochrome P450cam. Implications for the dioxygen activation mechanism
J.Biol.Chem., 280, 2005
2A1N
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BU of 2a1n by Molmil
Crystal structure of ferrous dioxygen complex of D251N cytochrome P450cam
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, CAMPHOR, Cytochrome P450-cam, ...
Authors:Nagano, S, Poulos, T.L.
Deposit date:2005-06-20
Release date:2005-07-05
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Crystallographic study on the dioxygen complex of wild-type and mutant cytochrome P450cam. Implications for the dioxygen activation mechanism
J.Biol.Chem., 280, 2005
5ZOI
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BU of 5zoi by Molmil
Crystal Structure of alpha1,3-Fucosyltransferase
Descriptor: Alpha-(1,3)-fucosyltransferase FucT, [[(2S,3R,4S,5R)-5-(2-azanyl-6-oxidanylidene-1H-purin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl] [(2S,3S,4S,5R,6R)-6-methyl-3,4,5-tris(oxidanyl)oxan-2-yl] hydrogen phosphate
Authors:Tan, Y, Yang, G.
Deposit date:2018-04-13
Release date:2019-06-26
Last modified:2024-03-27
Method:X-RAY DIFFRACTION (3.19 Å)
Cite:Directed evolution of an alpha 1,3-fucosyltransferase using a single-cell ultrahigh-throughput screening method.
Sci Adv, 5, 2019
2EZW
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BU of 2ezw by Molmil
Solution structure of the docking and dimerization domain of the type I alpha regulatory subunit of protein kinase A (RIalpha D/D)
Descriptor: cAMP-dependent protein kinase type I-alpha regulatory subunit
Authors:Banky, P.
Deposit date:2005-11-10
Release date:2006-02-14
Last modified:2018-01-24
Method:SOLUTION NMR
Cite:Related Protein-Protein Interaction Modules Present Drastically Different Surface Topographies Despite A Conserved Helical Platform
J.Mol.Biol., 330, 2003
6B40
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BU of 6b40 by Molmil
BbRAGL-3'TIR synaptic complex with nicked DNA refined with C2 symmetry
Descriptor: 31TIR intact strand, 31TIR pre-nicked strand of flanking DNA, 31TIR pre-nicked strand of signal DNA, ...
Authors:Zhang, Y, Cheng, T.C, Xiong, Y, Schatz, D.G.
Deposit date:2017-09-25
Release date:2019-03-20
Last modified:2024-03-13
Method:ELECTRON MICROSCOPY (4.3 Å)
Cite:Transposon molecular domestication and the evolution of the RAG recombinase.
Nature, 569, 2019
2X1Z
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BU of 2x1z by Molmil
Structure of Peridinin-Chlorophyll-Protein reconstituted with Chl-d
Descriptor: CADMIUM ION, CHLORIDE ION, CHLOROPHYLL D, ...
Authors:Schulte, T, Hiller, R.G, Hofmann, E.
Deposit date:2010-01-09
Release date:2010-02-09
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:X-Ray Structures of the Peridinin-Chlorophyll-Protein Reconstituted with Different Chlorophylls.
FEBS Lett., 584, 2010
2X20
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BU of 2x20 by Molmil
Structure of Peridinin-Chlorophyll-Protein reconstituted with Chl-b
Descriptor: CADMIUM ION, CHLORIDE ION, CHLOROPHYLL B, ...
Authors:Schulte, T, Hiller, R.G, Hofmann, E.
Deposit date:2010-01-09
Release date:2010-02-09
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:X-Ray Structures of the Peridinin-Chlorophyll-Protein Reconstituted with Different Chlorophylls.
FEBS Lett., 584, 2010
2X21
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BU of 2x21 by Molmil
Structure of Peridinin-Chlorophyll-Protein reconstituted with BChl-a
Descriptor: BACTERIOCHLOROPHYLL A, CADMIUM ION, CHLORIDE ION, ...
Authors:Schulte, T, Hiller, R.G, Hofmann, E.
Deposit date:2010-01-09
Release date:2010-02-09
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:X-Ray Structures of the Peridinin-Chlorophyll-Protein Reconstituted with Different Chlorophylls.
FEBS Lett., 584, 2010
1IWI
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BU of 1iwi by Molmil
Putidaredoxin-Binding Stablilizes an Active Conformer of Cytochrome P450cam in its Reduced State; Crystal Structure of Cytochrome P450cam
Descriptor: CAMPHOR, CYTOCHROME P450-CAM, PROTOPORPHYRIN IX CONTAINING FE
Authors:Nagano, S, Shimada, H, Tarumi, A, Hishiki, T, Kimata-Ariga, Y, Egawa, T, Park, S.-Y, Adachi, S, Shiro, Y, Ishimura, Y, RIKEN Structural Genomics/Proteomics Initiative (RSGI)
Deposit date:2002-05-15
Release date:2002-06-05
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (2 Å)
Cite:Infrared spectroscopic and mutational studies on putidaredoxin-induced conformational changes in ferrous CO-P450cam
Biochemistry, 42, 2003
2LQD
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BU of 2lqd by Molmil
Reduced and CO-bound cytochrome P450cam (CYP101A1)
Descriptor: CARBON MONOXIDE, Camphor 5-monooxygenase, POTASSIUM ION, ...
Authors:Pochapsky, T.C, Pochapsky, S.S, Asciutto, E, Madura, J, Young, M.J.
Deposit date:2012-03-02
Release date:2012-05-09
Last modified:2024-05-01
Method:SOLUTION NMR
Cite:Solution Structural Ensembles of Substrate-Free Cytochrome P450(cam).
Biochemistry, 51, 2012
4FYQ
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BU of 4fyq by Molmil
Human aminopeptidase N (CD13)
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ACETIC ACID, ...
Authors:Wong, A.H, Rini, J.M.
Deposit date:2012-07-05
Release date:2012-09-05
Last modified:2020-07-29
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:The X-ray Crystal Structure of Human Aminopeptidase N Reveals a Novel Dimer and the Basis for Peptide Processing.
J.Biol.Chem., 287, 2012
4OOY
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BU of 4ooy by Molmil
Avibactam and class C beta-lactamases: mechanism of inhibition, conservation of binding pocket and implications for resistance
Descriptor: (2S,5R)-1-formyl-5-[(sulfooxy)amino]piperidine-2-carboxamide, Beta-lactamase
Authors:Lahiri, S.D, Olivier, N.B, Alm, R.A.
Deposit date:2014-02-04
Release date:2014-08-20
Last modified:2018-02-14
Method:X-RAY DIFFRACTION (1.1 Å)
Cite:Avibactam and Class C beta-Lactamases: Mechanism of Inhibition, Conservation of the Binding Pocket, and Implications for Resistance.
Antimicrob.Agents Chemother., 58, 2014
4FYS
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BU of 4fys by Molmil
Human aminopeptidase N (CD13) in complex with angiotensin IV
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Aminopeptidase N, ...
Authors:Wong, A.H, Rini, J.M.
Deposit date:2012-07-05
Release date:2012-09-05
Last modified:2020-07-29
Method:X-RAY DIFFRACTION (2.01 Å)
Cite:The X-ray Crystal Structure of Human Aminopeptidase N Reveals a Novel Dimer and the Basis for Peptide Processing.
J.Biol.Chem., 287, 2012
4FYT
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BU of 4fyt by Molmil
Human aminopeptidase N (CD13) in complex with amastatin
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, AMASTATIN, ...
Authors:Wong, A.H, Rini, J.M.
Deposit date:2012-07-05
Release date:2012-09-05
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:The X-ray Crystal Structure of Human Aminopeptidase N Reveals a Novel Dimer and the Basis for Peptide Processing.
J.Biol.Chem., 287, 2012
2K6O
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BU of 2k6o by Molmil
Human LL-37 Structure
Descriptor: Cathelicidin antimicrobial peptide
Authors:Wang, G.
Deposit date:2008-07-14
Release date:2008-09-23
Last modified:2024-05-29
Method:SOLUTION NMR
Cite:Structures of human host defense cathelicidin LL-37 and its smallest antimicrobial peptide KR-12 in lipid micelles
J.Biol.Chem., 283, 2008
4FYR
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BU of 4fyr by Molmil
Human aminopeptidase N (CD13) in complex with bestatin
Descriptor: 2-(3-AMINO-2-HYDROXY-4-PHENYL-BUTYRYLAMINO)-4-METHYL-PENTANOIC ACID, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:Wong, A.H, Rini, J.M.
Deposit date:2012-07-05
Release date:2012-09-05
Last modified:2020-07-29
Method:X-RAY DIFFRACTION (1.91 Å)
Cite:The X-ray Crystal Structure of Human Aminopeptidase N Reveals a Novel Dimer and the Basis for Peptide Processing.
J.Biol.Chem., 287, 2012
3N29
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BU of 3n29 by Molmil
Crystal structure of carboxynorspermidine decarboxylase complexed with Norspermidine from Campylobacter jejuni
Descriptor: Carboxynorspermidine decarboxylase, GLYCEROL, N-(3-aminopropyl)propane-1,3-diamine, ...
Authors:Deng, X, Lee, J, Michael, A.J, Tomchick, D.R, Goldsmith, E.J, Phillips, M.A.
Deposit date:2010-05-17
Release date:2010-06-09
Last modified:2012-02-22
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Evolution of substrate specificity within a diverse family of beta/alpha-barrel-fold basic amino acid decarboxylases: X-ray structure determination of enzymes with specificity for L-arginine and carboxynorspermidine.
J.Biol.Chem., 285, 2010
2J9A
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BU of 2j9a by Molmil
blLAP in Complex with Microginin FR1
Descriptor: (2S,3R)-3-AMINO-2-HYDROXYDECANOIC ACID, (4S)-2-METHYL-2,4-PENTANEDIOL, CHLORIDE ION, ...
Authors:Kraft, M, Schleberger, C, Weckesser, J, Schulz, G.E.
Deposit date:2006-11-06
Release date:2006-12-06
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.73 Å)
Cite:Binding Structure of the Leucine Aminopeptidase Inhibitor Microginin Fr1.
FEBS Lett., 580, 2006
4HXX
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BU of 4hxx by Molmil
Pyridinylpyrimidines selectively inhibit human methionine aminopeptidase-1
Descriptor: (1R)-N~2~-[5-chloro-2-(5-chloropyridin-2-yl)-6-methylpyrimidin-4-yl]-1-phenyl-N~1~-(4-phenylbutyl)ethane-1,2-diamine, COBALT (II) ION, Methionine aminopeptidase 1, ...
Authors:Gabelli, S.B, Zhang, F, Liu, J, Amzel, L.M.
Deposit date:2012-11-12
Release date:2013-04-03
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2.09 Å)
Cite:Pyridinylpyrimidines selectively inhibit human methionine aminopeptidase-1.
Bioorg.Med.Chem., 21, 2013

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