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6FL2
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BU of 6fl2 by Molmil
Crystal structure of a dye-decolorizing peroxidase D143A variant from Klebsiella pneumoniae (KpDyP)
Descriptor: GLYCEROL, Iron-dependent peroxidase, MAGNESIUM ION, ...
Authors:Pfanzagl, V, Hofbauer, S, Mlynek, G.
Deposit date:2018-01-25
Release date:2018-08-08
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.270001 Å)
Cite:Roles of distal aspartate and arginine of B-class dye-decolorizing peroxidase in heterolytic hydrogen peroxide cleavage.
J. Biol. Chem., 293, 2018
6MHG
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BU of 6mhg by Molmil
Cryo-EM structure of the circumsporozoite protein of Plasmodium falciparum with a vaccine-elicited antibody reveals maturation of inter-antibody contacts
Descriptor: Fab311 heavy chain, Fab311 light chain, circumsporozoite protein
Authors:Cottrell, C.A, Torres, J.L, Ward, A.B.
Deposit date:2018-09-17
Release date:2018-10-31
Method:ELECTRON MICROSCOPY (3.57 Å)
Cite:Cryo-EM structure ofP. falciparumcircumsporozoite protein with a vaccine-elicited antibody is stabilized by somatically mutated inter-Fab contacts.
Sci Adv, 4, 2018
1SHX
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BU of 1shx by Molmil
Ephrin A5 ligand structure
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Ephrin-A5
Authors:Himanen, J.P, Barton, W.A, Nikolov, D.B, Jeffrey, P.D.
Deposit date:2004-02-26
Release date:2005-04-19
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Three distinct molecular surfaces in ephrin-A5 are essential for a functional interaction with EphA3.
J.Biol.Chem., 280, 2005
5BNC
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BU of 5bnc by Molmil
Structure of heme binding protein MSMEG_6519 from Mycobacterium smegmatis
Descriptor: 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, MAGNESIUM ION, NICKEL (II) ION, ...
Authors:Ahmed, F.H, Carr, P.D, Jackson, C.J.
Deposit date:2015-05-26
Release date:2015-10-21
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (2.25 Å)
Cite:Sequence-Structure-Function Classification of a Catalytically Diverse Oxidoreductase Superfamily in Mycobacteria.
J.Mol.Biol., 427, 2015
2Y6V
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BU of 2y6v by Molmil
Peroxisomal alpha-beta-hydrolase Lpx1 (Yor084w) from Saccharomyces cerevisiae (crystal form I)
Descriptor: PEROXISOMAL MEMBRANE PROTEIN LPX1, PHOSPHATE ION
Authors:Thoms, S, Niemann, H.H.
Deposit date:2011-01-26
Release date:2011-07-13
Last modified:2024-05-01
Method:X-RAY DIFFRACTION (2.83 Å)
Cite:The Unusual Extended C-Terminal Helix of the Peroxisomal Alpha-Beta-Hydrolase Lpx1 is Involved in Dimer Contacts But Dispensable for Dimerization
J.Struct.Biol., 175, 2011
5DX0
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BU of 5dx0 by Molmil
Crystal structure of CARM1, sinefungin, and H3 peptide (R17)
Descriptor: GLYCEROL, H3 peptide, Histone-arginine methyltransferase CARM1, ...
Authors:Boriack-Sjodin, P.A.
Deposit date:2015-09-23
Release date:2015-11-25
Last modified:2016-03-30
Method:X-RAY DIFFRACTION (2.05 Å)
Cite:Structural Insights into Ternary Complex Formation of Human CARM1 with Various Substrates.
Acs Chem.Biol., 11, 2016
5DXJ
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BU of 5dxj by Molmil
Crystal structure of CARM1 and sinefungin
Descriptor: GLYCEROL, Histone-arginine methyltransferase CARM1, SINEFUNGIN
Authors:Boriack-Sjodin, P.A.
Deposit date:2015-09-23
Release date:2015-11-25
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Structural Insights into Ternary Complex Formation of Human CARM1 with Various Substrates.
Acs Chem.Biol., 11, 2016
5DWQ
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BU of 5dwq by Molmil
Crystal structure of CARM1, sinefungin, and methylated H3 peptide (R17)
Descriptor: GLYCEROL, Histone-arginine methyltransferase CARM1, SINEFUNGIN, ...
Authors:Boriack-Sjodin, P.A.
Deposit date:2015-09-22
Release date:2015-11-25
Last modified:2016-03-30
Method:X-RAY DIFFRACTION (2.36 Å)
Cite:Structural Insights into Ternary Complex Formation of Human CARM1 with Various Substrates.
Acs Chem.Biol., 11, 2016
7YOU
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BU of 7you by Molmil
Cryo-EM structure of RNA polymerase in complex with P protein tetramer of Newcastle disease virus
Descriptor: NDV P protein, RNA-directed RNA polymerase L
Authors:Chen, Y, Jingyuan, C, Xiaoying, F.
Deposit date:2022-08-02
Release date:2023-02-15
Last modified:2023-08-30
Method:ELECTRON MICROSCOPY (3.41 Å)
Cite:Structure of the Newcastle Disease Virus L protein in complex with tetrameric phosphoprotein.
Nat Commun, 14, 2023
7YOV
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BU of 7yov by Molmil
Cryo-EM structure of RNA polymerase in complex with P protein tetramer of Newcastle disease virus
Descriptor: NDV P protein, RNA-directed RNA polymerase L
Authors:Chen, Y, Jingyuan, C, Xiaoying, F.
Deposit date:2022-08-02
Release date:2023-02-15
Last modified:2023-08-30
Method:ELECTRON MICROSCOPY (3.25 Å)
Cite:Structure of the Newcastle Disease Virus L protein in complex with tetrameric phosphoprotein.
Nat Commun, 14, 2023
5DX8
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BU of 5dx8 by Molmil
Crystal structure of CARM1, sinefungin, and methylated PABP1 peptide (R455)
Descriptor: Histone-arginine methyltransferase CARM1, SINEFUNGIN, methylated PABP1 peptide
Authors:Boriack-Sjodin, P.A.
Deposit date:2015-09-23
Release date:2015-11-25
Last modified:2016-03-30
Method:X-RAY DIFFRACTION (1.94 Å)
Cite:Structural Insights into Ternary Complex Formation of Human CARM1 with Various Substrates.
Acs Chem.Biol., 11, 2016
1OD8
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BU of 1od8 by Molmil
Xylanase Xyn10A from Streptomyces lividans in complex with xylobio-isofagomine lactam
Descriptor: ENDO-1,4-BETA-XYLANASE A, IMIDAZOLE, SODIUM ION, ...
Authors:Gloster, T.M, Roberts, S, Davies, G.J.
Deposit date:2003-02-14
Release date:2003-04-08
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.05 Å)
Cite:A Xylobiose-Derived Isofagomine Lactam Glycosidase Inhibitor Binds as its Amide Tautomer
Chem.Commun.(Camb.), 8, 2003
4BZD
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BU of 4bzd by Molmil
Structure of CDK2 in complex with a benzimidazopyrimidine
Descriptor: 6-(benzimidazol-1-yl)-N-[5-[3-(dimethylamino)propoxy]pyridin-2-yl]pyrimidin-4-amine, ACETATE ION, CYCLIN-DEPENDENT KINASE 2
Authors:Tucker, J.A, Valentine, A, Stanway, J, Brassington, C.
Deposit date:2013-07-25
Release date:2014-08-13
Last modified:2024-05-01
Method:X-RAY DIFFRACTION (1.83 Å)
Cite:Structure of Cdk2 in Complex with a Benzimidazopyrimidine
To be Published
5DX1
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BU of 5dx1 by Molmil
Crystal structure of CARM1, sinefungin, and PABP1 peptide (R455)
Descriptor: GLYCEROL, Histone-arginine methyltransferase CARM1, PABP1 peptide, ...
Authors:Boriack-Sjodin, P.A.
Deposit date:2015-09-23
Release date:2015-11-25
Last modified:2016-03-30
Method:X-RAY DIFFRACTION (1.93 Å)
Cite:Structural Insights into Ternary Complex Formation of Human CARM1 with Various Substrates.
Acs Chem.Biol., 11, 2016
4M09
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BU of 4m09 by Molmil
Crystal Structure of Mutant Chlorite Dismutase from Candidatus Nitrospira defluvii W146Y R173Q
Descriptor: 1,2-ETHANEDIOL, Chlorite dismutase, IMIDAZOLE, ...
Authors:Gysel, K, Hagmueller, A, Djinovic-Carugo, K.
Deposit date:2013-08-01
Release date:2014-01-15
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2.45 Å)
Cite:Manipulating conserved heme cavity residues of chlorite dismutase: effect on structure, redox chemistry, and reactivity.
Biochemistry, 53, 2014
2KV0
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BU of 2kv0 by Molmil
2-Aminopurine incorporation perturbs the dynamics and structure of DNA
Descriptor: DNA (5'-D(*CP*GP*AP*CP*GP*TP*TP*TP*GP*CP*AP*GP*C)-3'), DNA (5'-D(*GP*CP*TP*GP*CP*AP*(2PR)P*AP*CP*GP*TP*CP*G)-3')
Authors:Dallmann, A, Dehmel, L, Peters, T, Muegge, C, Griesinger, C.P, Tuma, J, Ernsting, N.P.
Deposit date:2010-03-03
Release date:2011-01-19
Last modified:2024-05-01
Method:SOLUTION NMR
Cite:2-Aminopurine incorporation perturbs the dynamics and structure of DNA.
Angew.Chem.Int.Ed.Engl., 49, 2010
1B9P
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BU of 1b9p by Molmil
NMR STRUCTURE OF HEPARIN BINDING SITE OF NON COLLAGENOUS DOMAIN I (NC1) OF COLLAGEN FACIT XIV
Descriptor: PROTEIN (COLLAGEN ALPHA 1)
Authors:Montserret, R, Deleage, G, Penin, F.
Deposit date:1999-02-15
Release date:1999-02-25
Last modified:2023-12-27
Method:SOLUTION NMR
Cite:Structural analysis of the heparin-binding site of the NC1 domain of collagen XIV by CD and NMR.
Biochemistry, 38, 1999
3ST2
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BU of 3st2 by Molmil
Dreiklang - equilibrium state
Descriptor: Dreiklang, PHOSPHATE ION
Authors:Brakemann, T, Weber, G, Andresen, M, Stiel, A.C, Jakobs, S, Wahl, M.C.
Deposit date:2011-07-08
Release date:2011-09-14
Last modified:2017-11-08
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:A reversibly photoswitchable GFP-like protein with fluorescence excitation decoupled from switching.
Nat.Biotechnol., 29, 2011
1AUW
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BU of 1auw by Molmil
H91N DELTA 2 CRYSTALLIN FROM DUCK
Descriptor: DELTA 2 CRYSTALLIN
Authors:Abu-Abed, M, Vallee, F, Howell, P.L.
Deposit date:1997-09-03
Release date:1998-03-18
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structural comparison of the enzymatically active and inactive forms of delta crystallin and the role of histidine 91.
Biochemistry, 36, 1997
3FC2
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BU of 3fc2 by Molmil
PLK1 in complex with BI6727
Descriptor: 1,2-ETHANEDIOL, ACETATE ION, DI(HYDROXYETHYL)ETHER, ...
Authors:Bader, G.
Deposit date:2008-11-21
Release date:2009-05-12
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (2.45 Å)
Cite:BI 6727, A Polo-like Kinase Inhibitor with Improved Pharmacokinetic Profile and Broad Antitumor Activity.
Clin.Cancer Res., 15, 2009
3GVA
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BU of 3gva by Molmil
Crystal Structure Analysis of S. Pombe ATL
Descriptor: Alkyltransferase-like protein 1
Authors:Tubbs, J.L, Arvai, A.S, Tainer, J.A.
Deposit date:2009-03-30
Release date:2009-06-09
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2 Å)
Cite:Flipping of alkylated DNA damage bridges base and nucleotide excision repair.
Nature, 459, 2009
3GX4
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BU of 3gx4 by Molmil
Crystal Structure Analysis of S. Pombe ATL in complex with DNA
Descriptor: Alkyltransferase-like protein 1, COBALT HEXAMMINE(III), DNA (5'-D(*CP*TP*AP*CP*TP*AP*GP*CP*CP*AP*TP*GP*G)-3'), ...
Authors:Tubbs, J.L, Arvai, A.S, Tainer, J.A.
Deposit date:2009-04-01
Release date:2009-06-09
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Flipping of alkylated DNA damage bridges base and nucleotide excision repair.
Nature, 459, 2009
6HMM
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BU of 6hmm by Molmil
POLYADPRIBOSYL GLYCOHYDROLASE IN COMPLEX WITH PDD00013907
Descriptor: DIMETHYL SULFOXIDE, GLYCEROL, Poly(ADP-ribose) glycohydrolase, ...
Authors:Tucker, J.A, Brassington, C, Hassall, G.
Deposit date:2018-09-12
Release date:2018-11-14
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Cell-Active Small Molecule Inhibitors of the DNA-Damage Repair Enzyme Poly(ADP-ribose) Glycohydrolase (PARG): Discovery and Optimization of Orally Bioavailable Quinazolinedione Sulfonamides.
J.Med.Chem., 61, 2018
3ST4
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BU of 3st4 by Molmil
Dreiklang - on state
Descriptor: Dreiklang, PHOSPHATE ION
Authors:Brakemann, T, Weber, G, Andresen, M, Stiel, A.C, Jakobs, S, Wahl, M.C.
Deposit date:2011-07-08
Release date:2011-09-14
Last modified:2017-11-08
Method:X-RAY DIFFRACTION (2 Å)
Cite:A reversibly photoswitchable GFP-like protein with fluorescence excitation decoupled from switching.
Nat.Biotechnol., 29, 2011
6HMN
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BU of 6hmn by Molmil
POLYADPRIBOSYL GLYCOSIDASE IN COMPLEX WITH PDD00014909
Descriptor: 3-methyl-6-[[(1-methylcyclopropyl)amino]-bis(oxidanyl)-$l^{4}-sulfanyl]-1-(phenylmethyl)quinazoline-2,4-dione, DIMETHYL SULFOXIDE, GLYCEROL, ...
Authors:Tucker, J.A, Brassington, C, Hassall, G.
Deposit date:2018-09-12
Release date:2018-11-14
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (2.87 Å)
Cite:Cell-Active Small Molecule Inhibitors of the DNA-Damage Repair Enzyme Poly(ADP-ribose) Glycohydrolase (PARG): Discovery and Optimization of Orally Bioavailable Quinazolinedione Sulfonamides.
J.Med.Chem., 61, 2018

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