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2N3D
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ATOMIC STRUCTURE OF THE CYTOSKELETAL BACTOFILIN BACA REVEALED BY SOLID-STATE NMR
Descriptor:Bactofilin A
Authors:Shi, C., Fricke, P., Lin, L., Chevelkov, V., Wegstroth, M., Giller, K., Becker, S., Thanbichler, M., Lange, A.
Deposit date:2015-05-29
Release date:2015-12-16
Last modified:2016-02-03
Method:SOLID-STATE NMR
Cite:Atomic-resolution structure of cytoskeletal bactofilin by solid-state NMR.
Sci Adv, 1, 2015
2L26
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RV0899 FROM MYCOBACTERIUM TUBERCULOSIS CONTAINS TWO SEPARATED DOMAINS
Descriptor:Uncharacterized protein Rv0899/MT0922
Authors:Shi, C., Li, J., Gao, Y., Wu, K., Huang, H., Tian, C.
Deposit date:2010-08-12
Release date:2011-08-17
Last modified:2011-12-07
Method:SOLUTION NMR
Cite:Structural Studies of Mycobacterium tuberculosis Rv0899 Reveal a Monomeric Membrane-Anchoring Protein with Two Separate Domains
J.Mol.Biol., 2011
2LQ9
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SOLUTION STRUCTURE OF THE K60A MUTANT OF ATOX1
Descriptor:Copper transport protein ATOX1
Authors:Xi, Z., Shi, C., Lai, C., Tian, C., Liu, Y.
Deposit date:2012-02-28
Release date:2013-03-27
Method:SOLUTION NMR
Cite:Solution structure of the K60A mutant of Atox1
To be Published
2M9M
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SOLUTION STRUCTURE OF ERCC4 DOMAIN OF HUMAN FAAP24
Descriptor:Fanconi anemia-associated protein of 24 kDa
Authors:Wu, F., Han, X., Shi, C., Gong, W., Tian, C.
Deposit date:2013-06-18
Release date:2013-09-18
Method:SOLUTION NMR
Cite:Structure analysis of FAAP24 reveals single-stranded DNA-binding activity and domain functions in DNA damage response
Cell Res., 2013
2M9N
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SOLUTION STRUCTURE OF (HHH)2 DOMAIN OF HUMAN FAAP24
Descriptor:Fanconi anemia-associated protein of 24 kDa
Authors:Wu, F., Han, X., Shi, C., Gong, W., Tian, C.
Deposit date:2013-06-18
Release date:2013-09-18
Method:SOLUTION NMR
Cite:Structure analysis of FAAP24 reveals single-stranded DNA-binding activity and domain functions in DNA damage response
Cell Res., 2013
3V3E
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CRYSTAL STRUCTURE OF THE HUMAN NUR77 LIGAND-BINDING DOMAIN
Descriptor:Nuclear receptor subfamily 4 group A member 1, GLYCEROL
Authors:Zhang, Q., Shi, C., Yang, K., Chen, Y., Zhan, Y., Wu, Q., Lin, T.
Deposit date:2011-12-13
Release date:2012-09-26
Last modified:2013-07-10
Method:X-RAY DIFFRACTION (2.06 Å)
Cite:The orphan nuclear receptor Nur77 regulates LKB1 localization and activates AMPK
Nat.Chem.Biol., 8, 2012
3V3Q
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CRYSTAL STRUCTURE OF HUMAN NUR77 LIGAND-BINDING DOMAIN IN COMPLEX WITH ETHYL 2-[2,3,4 TRIMETHOXY-6(1-OCTANOYL)PHENYL]ACETATE
Descriptor:Nuclear receptor subfamily 4 group A member 1, ethyl (2,3,4-trimethoxy-6-octanoylphenyl)acetate, GLYCEROL, ...
Authors:Zhang, Q., Shi, C., Yang, K., Chen, Y., Zhan, Y., Wu, Q., Lin, T.
Deposit date:2011-12-14
Release date:2012-09-26
Last modified:2013-07-10
Method:X-RAY DIFFRACTION (2.22 Å)
Cite:The orphan nuclear receptor Nur77 regulates LKB1 localization and activates AMPK
Nat.Chem.Biol., 8, 2012
6D2L
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CRYSTAL STRUCTURE OF HUMAN CARM1 WITH (S)-SKI-72
Descriptor:Histone-arginine methyltransferase CARM1, (2S,5S)-2-amino-6-[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]-5-[(benzylamino)methyl]-N-[2-(4-hydroxyphenyl)ethyl]hexanamide, SULFATE ION, ...
Authors:DONG, A., ZENG, H., WALKER, J.R., Hutchinson, A., Seitova, A., LUO, M., CAI, X.C., KE, W., WANG, J., SHI, C., ZHENG, W., LEE, J.P., IBANEZ, G., Bountra, C., Arrowsmith, C.H., Edwards, A.M., BROWN, P.J., WU, H., Structural Genomics Consortium (SGC)
Deposit date:2018-04-13
Release date:2018-05-23
Method:X-RAY DIFFRACTION (2 Å)
Cite:Crystal structure of human CARM1 with (S)-SKI-72
to be published
6DVR
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CRYSTAL STRUCTURE OF HUMAN CARM1 WITH (R)-SKI-72
Descriptor:Histone-arginine methyltransferase CARM1, (2R,5S)-2-amino-6-[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]-5-[(benzylamino)methyl]-N-[2-(4-methoxyphenyl)ethyl]hexanamide (non-preferred name), 2,5,8,11,14,17-HEXAOXANONADECAN-19-OL, ...
Authors:Dong, A., Zeng, H., Hutchinson, A., Seitova, A., Luo, M., Cai, X.C., Ke, W., Wang, J., Shi, C., Zheng, W., Lee, J.P., Ibanez, G., Bountra, C., Arrowsmith, C.H., Edwards, A.M., Brown, P.J., Structural Genomics Consortium (SGC)
Deposit date:2018-06-25
Release date:2018-07-25
Method:X-RAY DIFFRACTION (1.54 Å)
Cite:Crystal structure of human CARM1 with (R)-SKI-72
to be published
6ILW
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CRYSTAL STRCUTURE OF PETASE FROM IDEONELLA SAKAIENSIS
Descriptor:Poly(ethylene terephthalate) hydrolase, CHLORIDE ION, SODIUM ION
Authors:Liu, C.C., Shi, C.
Deposit date:2018-10-19
Release date:2019-03-27
Last modified:2019-04-10
Method:X-RAY DIFFRACTION (1.575 Å)
Cite:Structural and functional characterization of polyethylene terephthalate hydrolase from Ideonella sakaiensis.
Biochem. Biophys. Res. Commun., 508, 2019
6ILX
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CRYSTAL STRCUTURE OF PETASE W159F MUTANT FROM IDEONELLA SAKAIENSIS
Descriptor:Poly(ethylene terephthalate) hydrolase, CHLORIDE ION, SODIUM ION
Authors:Liu, C.C., Shi, C.
Deposit date:2018-10-20
Release date:2019-03-27
Last modified:2019-04-10
Method:X-RAY DIFFRACTION (1.45 Å)
Cite:Structural and functional characterization of polyethylene terephthalate hydrolase from Ideonella sakaiensis.
Biochem. Biophys. Res. Commun., 508, 2019
2MSG
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SOLID-STATE NMR STRUCTURE OF UBIQUITIN
Descriptor:Ubiquitin
Authors:Lakomek, N., Habenstein, B., Loquet, A., Shi, C., Giller, K., Wolff, S., Becker, S., Fasshuber, H., Lange, A.
Deposit date:2014-08-04
Release date:2015-02-18
Last modified:2015-05-13
Method:SOLID-STATE NMR
Cite:Structural heterogeneity in microcrystalline ubiquitin studied by solid-state NMR.
Protein Sci., 24, 2015
4DG8
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STRUCTURE OF PA1221, AN NRPS PROTEIN CONTAINING ADENYLATION AND PCP DOMAINS
Descriptor:PA1221, ADENOSINE MONOPHOSPHATE, (R,R)-2,3-BUTANEDIOL
Authors:Mitchell, C.A., Shi, C., Aldrich, C.C., Gulick, A.M.
Deposit date:2012-01-25
Release date:2012-05-02
Method:X-RAY DIFFRACTION (2.15 Å)
Cite:Structure of PA1221, a Nonribosomal Peptide Synthetase Containing Adenylation and Peptidyl Carrier Protein Domains.
Biochemistry, 51, 2012
4DG9
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STRUCTURE OF HOLO-PA1221, AN NRPS PROTEIN CONTAINING ADENYLATION AND PCP DOMAINS BOUND TO VINYLSULFONAMIDE INHIBITOR
Descriptor:PA1221, 5'-({[(2R,3R)-3-amino-2-{[2-({N-[(2R)-2-hydroxy-3,3-dimethyl-4-{[oxido(oxo)phosphonio]oxy}butanoyl]-beta-alanyl}amino)ethyl]sulfanyl}-4-methylpentyl]sulfonyl}amino)-5'-deoxyadenosine
Authors:Mitchell, C.A., Shi, C., Aldrich, C.C., Gulick, A.M.
Deposit date:2012-01-25
Release date:2012-05-02
Method:X-RAY DIFFRACTION (2.55 Å)
Cite:Structure of PA1221, a Nonribosomal Peptide Synthetase Containing Adenylation and Peptidyl Carrier Protein Domains.
Biochemistry, 51, 2012
3TFT
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CRYSTAL STRUCTURE OF 7,8-DIAMINOPELARGONIC ACID SYNTHASE (BIOA) FROM MYCOBACTERIUM TUBERCULOSIS, PRE-REACTION COMPLEX WITH A 3,6-DIHYDROPYRID-2-ONE HETEROCYCLE INHIBITOR
Descriptor:Adenosylmethionine-8-amino-7-oxononanoate aminotransferase, PYRIDOXAL-5'-PHOSPHATE, DIMETHYL SULFOXIDE
Authors:Geders, T.W., Finzel, B.C.
Deposit date:2011-08-16
Release date:2011-10-19
Last modified:2011-11-23
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Mechanism-based Inactivation by Aromatization of the Transaminase BioA Involved in Biotin Biosynthesis in Mycobaterium tuberculosis.
J.Am.Chem.Soc., 133, 2011
3TFU
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CRYSTAL STRUCTURE OF 7,8-DIAMINOPELARGONIC ACID SYNTHASE (BIOA) FROM MYCOBACTERIUM TUBERCULOSIS, POST-REACTION COMPLEX WITH A 3,6-DIHYDROPYRID-2-ONE HETEROCYCLE INHIBITOR
Descriptor:Adenosylmethionine-8-amino-7-oxononanoate aminotransferase, [5-hydroxy-4-({[6-(3-hydroxypropyl)-2-oxo-1,2-dihydropyridin-3-yl]amino}methyl)-6-methylpyridin-3-yl]methyl dihydrogen phosphate, DIMETHYL SULFOXIDE
Authors:Geders, T.W., Finzel, B.C.
Deposit date:2011-08-16
Release date:2011-10-19
Last modified:2011-11-23
Method:X-RAY DIFFRACTION (1.94 Å)
Cite:Mechanism-based Inactivation by Aromatization of the Transaminase BioA Involved in Biotin Biosynthesis in Mycobaterium tuberculosis.
J.Am.Chem.Soc., 133, 2011
5JA1
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ENTF, A TERMINAL NONRIBOSOMAL PEPTIDE SYNTHETASE MODULE BOUND TO THE MBTH-LIKE PROTEIN YBDZ
Descriptor:Enterobactin synthase component F, Enterobactin biosynthesis protein YbdZ, 5'-({[(2R,3S)-3-amino-4-hydroxy-2-{[2-({N-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alanyl}amino)ethyl]sulfanyl}butyl]sulfonyl}amino)-5'-deoxyadenosine, ...
Authors:Miller, B.R., Gulick, A.M.
Deposit date:2016-04-11
Release date:2016-09-14
Last modified:2017-09-20
Method:X-RAY DIFFRACTION (3 Å)
Cite:Structures of a Nonribosomal Peptide Synthetase Module Bound to MbtH-like Proteins Support a Highly Dynamic Domain Architecture.
J.Biol.Chem., 291, 2016
5JA2
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ENTF, A TERMINAL NONRIBOSOMAL PEPTIDE SYNTHETASE MODULE BOUND TO THE NON-NATIVE MBTH-LIKE PROTEIN PA2412
Descriptor:Enterobactin synthase component F, MbtH-Like Protein PA2412, 5'-({[(2R,3S)-3-amino-4-hydroxy-2-{[2-({N-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alanyl}amino)ethyl]sulfanyl}butyl]sulfonyl}amino)-5'-deoxyadenosine, ...
Authors:Miller, B.R., Gulick, A.M.
Deposit date:2016-04-11
Release date:2016-09-14
Last modified:2017-09-20
Method:X-RAY DIFFRACTION (3 Å)
Cite:Structures of a Nonribosomal Peptide Synthetase Module Bound to MbtH-like Proteins Support a Highly Dynamic Domain Architecture.
J.Biol.Chem., 291, 2016
3DIW
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C-TERMINAL BETA-CATENIN BOUND TIP-1 STRUCTURE
Descriptor:Tax1-binding protein 3, decameric peptide form Catenin beta-1
Authors:Shen, Y.
Deposit date:2008-06-21
Release date:2008-10-21
Last modified:2014-02-05
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Structural Basis of beta-Catenin Recognition by Tax-interacting Protein-1
J.Mol.Biol., 384, 2008
3DJ1
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CRYSTAL STRUCTURE OF TIP-1 WILD TYPE
Descriptor:Tax1-binding protein 3, SULFATE ION
Authors:Shen, Y.
Deposit date:2008-06-21
Release date:2008-10-21
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Structural Basis of beta-Catenin Recognition by Tax-interacting Protein-1
J.Mol.Biol., 384, 2008
3DJ3
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CRYSTAL STRUCTURE OF C-TERMINAL TRUNCATED TIP-1 (6-113)
Descriptor:Tax1-binding protein 3
Authors:Shen, Y.
Deposit date:2008-06-21
Release date:2008-10-21
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Structural Basis of beta-Catenin Recognition by Tax-interacting Protein-1
J.Mol.Biol., 384, 2008
3GJ9
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CRYSTAL STRUCTURE OF TIP-1 IN COMPLEX WITH C-TERMINAL OF KIR2.3
Descriptor:Tax1-binding protein 3, C-terminal peptide from Inward rectifier potassium channel 4, ZINC ION, ...
Authors:Shen, Y.
Deposit date:2009-03-08
Release date:2009-12-15
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Molecular mechanism of inward rectifier potassium channel 2.3 regulation by tax-interacting protein-1
J.Mol.Biol., 392, 2009
3RG2
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STRUCTURE OF A TWO-DOMAIN NRPS FUSION PROTEIN CONTAINING THE ENTE ADENYLATION DOMAIN AND ENTB ARYL-CARRIER PROTEIN FROM ENTEROBACTIN BIOSYNTHESIS
Descriptor:Enterobactin synthase component E (entE), 2,3-dihydro-2,3-dihydroxybenzoate synthetase, isochroismatase (Entb), ...
Authors:Sundlov, J.A., Gulick, A.M.
Deposit date:2011-04-07
Release date:2012-03-07
Last modified:2017-08-09
Method:X-RAY DIFFRACTION (3.1 Å)
Cite:Structural and Functional Investigation of the Intermolecular Interaction between NRPS Adenylation and Carrier Protein Domains.
Chem.Biol., 19, 2012
4UMX
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IDH1 R132H IN COMPLEX WITH CPD 1
Descriptor:ISOCITRATE DEHYDROGENASE [NADP] CYTOPLASMIC, 2,6-bis(1H-imidazol-1-ylmethyl)-4-(2,4,4-trimethylpentan-2-yl)phenol, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
Authors:Mathieu, M., Marquette, J.P.
Deposit date:2014-05-22
Release date:2014-11-19
Last modified:2017-08-23
Method:X-RAY DIFFRACTION (1.88 Å)
Cite:Selective Inhibition of Mutant Isocitrate Dehydrogenase 1 (Idh1) Via Disruption of a Metal Binding Network by an Allosteric Small Molecule.
J.Biol.Chem., 290, 2015
4UMY
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IDH1 R132H IN COMPLEX WITH CPD 1
Descriptor:ISOCITRATE DEHYDROGENASE [NADP] CYTOPLASMIC, SULFATE ION, GLYCEROL, ...
Authors:McLean, L., Zhang, Y., Mathieu, M.
Deposit date:2014-05-22
Release date:2014-11-19
Last modified:2017-03-29
Method:X-RAY DIFFRACTION (2.07 Å)
Cite:Selective Inhibition of Mutant Isocitrate Dehydrogenase 1 (Idh1) Via Disruption of a Metal Binding Network by an Allosteric Small Molecule.
J.Biol.Chem., 290, 2015
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