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5VHB
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BU of 5vhb by Molmil
Crystal structure of Protein Kinase A in complex with the PKI peptide and Aminobenzothiazole based inhibitor
Descriptor: N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-4-(pyridin-4-yl)benzamide, PKI peptide, cAMP-dependent protein kinase catalytic subunit alpha
Authors:Judge, R.A.
Deposit date:2017-04-12
Release date:2018-01-31
Last modified:2018-04-04
Method:X-RAY DIFFRACTION (1.61 Å)
Cite:Design of Aminobenzothiazole Inhibitors of Rho Kinases 1 and 2 by Using Protein Kinase A as a Structure Surrogate.
Chembiochem, 19, 2018
5VIB
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BU of 5vib by Molmil
Crystal structure of Protein Kinase A in complex with the PKI peptide and Aminobenzothiazole based inhibitors
Descriptor: 3-({[6-(pyridin-4-yl)-1,3-benzothiazol-2-yl][2-(pyrrolidin-1-yl)ethyl]amino}methyl)phenol, PKI peptide, cAMP-dependent protein kinase catalytic subunit alpha
Authors:Judge, R.A.
Deposit date:2017-04-14
Release date:2018-01-31
Last modified:2018-04-04
Method:X-RAY DIFFRACTION (2.37 Å)
Cite:Design of Aminobenzothiazole Inhibitors of Rho Kinases 1 and 2 by Using Protein Kinase A as a Structure Surrogate.
Chembiochem, 19, 2018
5VI9
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BU of 5vi9 by Molmil
Crystal structure of Protein Kinase A in complex with the PKI peptide and Aminobenzothiazole based inhibitors
Descriptor: N-[(3-fluorophenyl)methyl]-6-(pyridin-4-yl)-1,3-benzothiazol-2-amine, PKI peptide, cAMP-dependent protein kinase catalytic subunit alpha
Authors:Judge, R.A.
Deposit date:2017-04-14
Release date:2018-01-31
Last modified:2018-04-04
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Design of Aminobenzothiazole Inhibitors of Rho Kinases 1 and 2 by Using Protein Kinase A as a Structure Surrogate.
Chembiochem, 19, 2018
6ZEA
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BU of 6zea by Molmil
Strictosidine Synthase from Catharanthus roseus in complex with racemic 1-methyl-2,3,4,9-tetrahydro-1H-beta-carboline
Descriptor: (1~{R})-1-methyl-2,3,4,9-tetrahydro-1~{H}-pyrido[3,4-b]indole, (1~{S})-1-methyl-2,3,4,9-tetrahydro-1~{H}-pyrido[3,4-b]indole, 1,2-ETHANEDIOL, ...
Authors:Eger, E, Sharma, M, Kroutil, W, Grogan, G.
Deposit date:2020-06-16
Release date:2020-09-02
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.54 Å)
Cite:Strictosidine Synthase from Catharanthus roseus in complex with racemic 1-methyl-2,3,4,9-tetrahydro-1H-beta-carboline
To Be Published
2GH4
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BU of 2gh4 by Molmil
YteR/D143N/dGalA-Rha
Descriptor: 2,6-anhydro-3-deoxy-L-threo-hex-2-enonic acid-(1-2)-alpha-L-rhamnopyranose, Putative glycosyl hydrolase yteR
Authors:Itoh, T, Ochiai, A, Mikami, B, Hashimoto, W, Murata, K.
Deposit date:2006-03-25
Release date:2006-08-29
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Structure of unsaturated rhamnogalacturonyl hydrolase complexed with substrate
Biochem.Biophys.Res.Commun., 347, 2006
3HC7
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BU of 3hc7 by Molmil
Crystal structure of lysin B from Mycobacteriophage D29
Descriptor: Gene 12 protein
Authors:Sun, Q, Sacchettini, J.C.
Deposit date:2009-05-05
Release date:2009-07-21
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2 Å)
Cite:Mycobacteriophage Lysin B is a novel mycolylarabinogalactan esterase
Mol.Microbiol., 73, 2009
2GEX
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BU of 2gex by Molmil
Crystal structure of SnoaL2 a putative hydroxylase from Streptomyces nogalater
Descriptor: SnoL
Authors:Beinker, P, Lohkamp, B, Schneider, G.
Deposit date:2006-03-21
Release date:2006-07-18
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Crystal structures of SnoaL2 and AclR: two putative hydroxylases in the biosynthesis of aromatic polyketide antibiotics
J.Mol.Biol., 359, 2006
2GHB
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BU of 2ghb by Molmil
Thermotoga maritima maltotriose binding protein, ligand free form
Descriptor: maltose ABC transporter, periplasmic maltose-binding protein
Authors:Cuneo, M.J, Changela, A, Hocker, B, Beese, L.S, Hellinga, H.W.
Deposit date:2006-03-27
Release date:2007-02-06
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:T. maritima maltotriose binding protein open form
To be Published
7QZN
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BU of 7qzn by Molmil
Amine Dehydrogenase from Cystobacter fuscus (CfusAmDH) W145A mutant with NAD+
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, Amine Dehydrogenase, NICOTINAMIDE-ADENINE-DINUCLEOTIDE
Authors:Bennett, M, Ducrot, L, Vaxelaire-Vergne, C, Grogan, G.
Deposit date:2022-01-31
Release date:2022-12-07
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.64 Å)
Cite:Cover Feature: Expanding the Substrate Scope of Native Amine Dehydrogenases through In Silico Structural Exploration and Targeted Protein Engineering (ChemCatChem 22/2022)
Chemcatchem, 14, 2022
7QZL
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BU of 7qzl by Molmil
Amine Dehydrogenase from Cystobacter fuscus (CfusAmDH) W145A mutant with NADP+ and pentylamine
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, AMYLAMINE, Amine Dehydrogenase, ...
Authors:Bennett, M, Ducrot, L, Vaxelaire-Vergne, C, Grogan, G.
Deposit date:2022-01-31
Release date:2022-12-07
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Cover Feature: Expanding the Substrate Scope of Native Amine Dehydrogenases through In Silico Structural Exploration and Targeted Protein Engineering (ChemCatChem 22/2022)
Chemcatchem, 14, 2022
7LII
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BU of 7lii by Molmil
Thermotoga maritima Encapsulin Nanocompartment Pore Mutant S7D
Descriptor: Maritimacin, RIBOFLAVIN
Authors:Andreas, M.P, Adamson, L, Tasneem, N, Close, W, Giessen, T, Lau, Y.H.
Deposit date:2021-01-27
Release date:2022-02-09
Last modified:2024-05-29
Method:ELECTRON MICROSCOPY (3.55 Å)
Cite:Pore structure controls stability and molecular flux in engineered protein cages.
Sci Adv, 8, 2022
7LIL
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BU of 7lil by Molmil
Thermotoga maritima Encapsulin Nanocompartment Pore Mutant SE3
Descriptor: Maritimacin, RIBOFLAVIN
Authors:Andreas, M.P, Adamson, L, Tasneem, N, Close, W, Giessen, T, Lau, Y.H.
Deposit date:2021-01-27
Release date:2022-02-09
Last modified:2024-05-29
Method:ELECTRON MICROSCOPY (2.84 Å)
Cite:Pore structure controls stability and molecular flux in engineered protein cages.
Sci Adv, 8, 2022
7LIJ
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BU of 7lij by Molmil
Thermotoga maritima Encapsulin Nanocompartment Pore Mutant S1K
Descriptor: Maritimacin, RIBOFLAVIN
Authors:Andreas, M.P, Adamson, L, Tasneem, N, Close, W, Giessen, T, Lau, Y.H.
Deposit date:2021-01-27
Release date:2022-02-09
Last modified:2024-05-29
Method:ELECTRON MICROSCOPY (2.84 Å)
Cite:Pore structure controls stability and molecular flux in engineered protein cages.
Sci Adv, 8, 2022
7LIK
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BU of 7lik by Molmil
Thermotoga maritima Encapsulin Nanocompartment Pore Mutant S1R
Descriptor: Maritimacin, RIBOFLAVIN
Authors:Andreas, M.P, Adamson, L, Tasneem, N, Close, W, Giessen, T, Lau, Y.H.
Deposit date:2021-01-27
Release date:2022-02-09
Last modified:2024-05-29
Method:ELECTRON MICROSCOPY (2.91 Å)
Cite:Pore structure controls stability and molecular flux in engineered protein cages.
Sci Adv, 8, 2022
5KDD
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BU of 5kdd by Molmil
Apo-structure of humanised RadA-mutant humRadA22
Descriptor: DNA repair and recombination protein RadA, SULFATE ION
Authors:Fischer, G, Marsh, M, Moschetti, T, Sharpe, T, Scott, D, Morgan, M, Ng, H, Skidmore, J, Venkitaraman, A, Abell, C, Blundell, T.L, Hyvonen, M.
Deposit date:2016-06-08
Release date:2016-10-19
Last modified:2024-06-19
Method:X-RAY DIFFRACTION (1.99 Å)
Cite:Engineering Archeal Surrogate Systems for the Development of Protein-Protein Interaction Inhibitors against Human RAD51.
J.Mol.Biol., 428, 2016
6JYZ
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BU of 6jyz by Molmil
Crystal structure of endogalactoceramidase
Descriptor: 1,2-ETHANEDIOL, 2-{2-[2-(2-{2-[2-(2-ETHOXY-ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)-ETHOXY]-ETHOXY}-ETHANOL, ISOPROPYL ALCOHOL, ...
Authors:Liuqing, C, Yan, F.
Deposit date:2019-04-29
Release date:2019-10-02
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (1.35 Å)
Cite:Structure of an endogalactosylceramidase from Rhodococcus hoagii 103S reveals the molecular basis of its substrate specificity.
J.Struct.Biol., 208, 2019
4F8V
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BU of 4f8v by Molmil
Crystal structure of the bacterial ribosomal decoding site in complex with sisomicin (P21212 form)
Descriptor: (1S,2S,3R,4S,6R)-4,6-diamino-3-{[(2S,3R)-3-amino-6-(aminomethyl)-3,4-dihydro-2H-pyran-2-yl]oxy}-2-hydroxycyclohexyl 3-deoxy-4-C-methyl-3-(methylamino)-beta-L-arabinopyranoside, RNA (5'-R(P*GP*CP*GP*UP*CP*AP*CP*AP*CP*CP*GP*GP*UP*GP*AP*AP*GP*UP*CP*GP*C)-3')
Authors:Kondo, J, Koganei, M, Kasahara, T.
Deposit date:2012-05-18
Release date:2012-08-15
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Crystal structure and specific binding mode of sisomicin to the bacterial ribosomal decoding site.
Acs Med.Chem.Lett., 3, 2012
6D69
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BU of 6d69 by Molmil
Crystal Structure of the NHL Repeat Region of D. melanogaster Thin
Descriptor: GLYCEROL, NHL Repeat Region of D. melanogaster Thin
Authors:Ramyar, K.X, McWhorter, W.J, Geisbrecht, B.V.
Deposit date:2018-04-20
Release date:2019-04-24
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (2.601 Å)
Cite:DrosophilaTRIM32 cooperates with glycolytic enzymes to promote cell growth.
Elife, 9, 2020
7LIM
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BU of 7lim by Molmil
Thermotoga maritima Encapsulin Nanocompartment Pore Mutant S6E
Descriptor: Maritimacin, RIBOFLAVIN
Authors:Andreas, M.P, Adamson, L, Tasneem, N, Close, W, Giessen, T, Lau, Y.H.
Deposit date:2021-01-27
Release date:2022-02-09
Last modified:2024-05-29
Method:ELECTRON MICROSCOPY (2.75 Å)
Cite:Pore structure controls stability and molecular flux in engineered protein cages.
Sci Adv, 8, 2022
7LIS
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BU of 7lis by Molmil
Thermotoga maritima Encapsulin Nanocompartment Pore Mutant S5D
Descriptor: Maritimacin, RIBOFLAVIN
Authors:Andreas, M.P, Adamson, L, Tasneem, N, Close, W, Giessen, T, Lau, Y.H.
Deposit date:2021-01-27
Release date:2022-02-09
Last modified:2024-05-29
Method:ELECTRON MICROSCOPY (2.96 Å)
Cite:Pore structure controls stability and molecular flux in engineered protein cages.
Sci Adv, 8, 2022
7LIT
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BU of 7lit by Molmil
Thermotoga maritima Encapsulin Nanocompartment Pore Mutant S7G
Descriptor: Maritimacin, RIBOFLAVIN
Authors:Andreas, M.P, Adamson, L, Tasneem, N, Close, W, Giessen, T, Lau, Y.H.
Deposit date:2021-01-27
Release date:2022-02-09
Last modified:2024-05-29
Method:ELECTRON MICROSCOPY (2.53 Å)
Cite:Pore structure controls stability and molecular flux in engineered protein cages.
Sci Adv, 8, 2022
5VRA
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BU of 5vra by Molmil
2.35-Angstrom In situ Mylar structure of human A2A adenosine receptor at 100 K
Descriptor: (2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate, (2S)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate, 4-{2-[(7-amino-2-furan-2-yl[1,2,4]triazolo[1,5-a][1,3,5]triazin-5-yl)amino]ethyl}phenol, ...
Authors:Broecker, J, Morizumi, T, Ou, W.-L, Klingel, V, Kuo, A, Kissick, D.J, Ishchenko, A, Lee, M.-Y, Xu, S, Makarov, O, Cherezov, V, Ogata, C.M, Ernst, O.P.
Deposit date:2017-05-10
Release date:2017-12-13
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (2.35 Å)
Cite:High-throughput in situ X-ray screening of and data collection from protein crystals at room temperature and under cryogenic conditions.
Nat Protoc, 13, 2018
3HHX
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BU of 3hhx by Molmil
Crystal structure determination of Catechol 1,2-Dioxygenase from Rhodococcus opacus 1CP in complex with pyrogallol
Descriptor: (4S,7R)-4-HYDROXY-N,N,N-TRIMETHYL-9-OXO-7-[(PALMITOYLOXY)METHYL]-3,5,8-TRIOXA-4-PHOSPHAHEXACOSAN-1-AMINIUM 4-OXIDE, BENZENE-1,2,3-TRIOL, Catechol 1,2-dioxygenase, ...
Authors:Matera, I, Ferraroni, M, Briganti, F.
Deposit date:2009-05-18
Release date:2010-01-26
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2 Å)
Cite:Catechol 1,2-dioxygenase from the Gram-positive Rhodococcus opacus 1CP: Quantitative structure/activity relationship and the crystal structures of native enzyme and catechols adducts.
J.Struct.Biol., 170, 2010
5VZL
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BU of 5vzl by Molmil
cryo-EM structure of the Cas9-sgRNA-AcrIIA4 anti-CRISPR complex
Descriptor: CRISPR-associated endonuclease Cas9, phage anti-CRISPR AcrIIA4, single guide RNA (116-MER)
Authors:Jiang, F, Liu, J.J, Nogales, E, Doudna, J.A.
Deposit date:2017-05-29
Release date:2017-07-26
Last modified:2024-03-13
Method:ELECTRON MICROSCOPY (3.9 Å)
Cite:Disabling Cas9 by an anti-CRISPR DNA mimic.
Sci Adv, 3, 2017
1MML
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BU of 1mml by Molmil
MECHANISTIC IMPLICATIONS FROM THE STRUCTURE OF A CATALYTIC FRAGMENT OF MMLV REVERSE TRANSCRIPTASE
Descriptor: MMLV REVERSE TRANSCRIPTASE
Authors:Georgiadis, M.M, Jessen, S.M, Ogata, C.M, Telesnitsky, A, Goff, S.P, Hendrickson, W.A.
Deposit date:1995-07-18
Release date:1995-10-15
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Mechanistic implications from the structure of a catalytic fragment of Moloney murine leukemia virus reverse transcriptase.
Structure, 3, 1995

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