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Pantothenate synthase in complex with 2-(5-methoxy-2-(tosylcarbamoyl)-1H-indol-1-yl)acetic acid
Descriptor:	(5-methoxy-2-{[(4-methylphenyl)sulfonyl]carbamoyl}-1H-indol-1-yl)acetic acid, 1,2-ETHANEDIOL, ETHANOL, ...
Authors:	Silvestre, H.L, Blundell, T.L.
Deposit date:	2013-09-15
Release date:	2014-08-27
Last modified:	2024-02-28
Method:	X-RAY DIFFRACTION (1.7 Å)
Cite:	Optimization of Inhibitors of Mycobacterium tuberculosis Pantothenate Synthetase Based on Group Efficiency Analysis. Chemmedchem, 11, 2016

4MUE

Crystal strcture of pantothenate synthetase in complex with 2-(5-methoxy-2-(4-(trifluoromethyl)phenylsulfonylcarbamoyl)-1H-indol-1-yl)acetic acid
Descriptor:	1,2-ETHANEDIOL, ETHANOL, Pantothenate synthetase, ...
Authors:	Silvestre, H.L, Blundell, T.L.
Deposit date:	2013-09-21
Release date:	2014-08-27
Last modified:	2023-09-20
Method:	X-RAY DIFFRACTION (2.06 Å)
Cite:	Optimization of Inhibitors of Mycobacterium tuberculosis Pantothenate Synthetase Based on Group Efficiency Analysis. Chemmedchem, 11, 2016

4MUF

Crystal structure of pantothenate synthetase in complex with 2-(2-(4-tert-butylphenylsulfonylcarbamoyl)-5-methoxy-1H-indol-1-yl)acetic acid
Descriptor:	(2-{[(4-tert-butylphenyl)sulfonyl]carbamoyl}-5-methoxy-1H-indol-1-yl)acetic acid, ETHANOL, Pantothenate synthetase
Authors:	Silvestre, H.L, Blundell, T.L.
Deposit date:	2013-09-21
Release date:	2014-08-27
Last modified:	2023-09-20
Method:	X-RAY DIFFRACTION (2.5 Å)
Cite:	Optimization of Inhibitors of Mycobacterium tuberculosis Pantothenate Synthetase Based on Group Efficiency Analysis. Chemmedchem, 11, 2016

5TJ3

Crystal structure of wild type alkaline phosphatase PafA to 1.7A resolution
Descriptor:	Alkaline phosphatase PafA, ZINC ION
Authors:	Lyubimov, A.Y, Sunden, F, Ressl, S, Herschlag, D.
Deposit date:	2016-10-03
Release date:	2016-11-16
Last modified:	2023-10-04
Method:	X-RAY DIFFRACTION (1.7 Å)
Cite:	Mechanistic and Evolutionary Insights from Comparative Enzymology of Phosphomonoesterases and Phosphodiesterases across the Alkaline Phosphatase Superfamily. J.Am.Chem.Soc., 138, 2016

4HB0

Crystal structure of CRM1 inhibitor Leptomycin B in complex with CRM1(K541Q,K542Q,R543S,K545Q,K548Q,K579Q)-Ran-RanBP1
Descriptor:	CHLORIDE ION, Exportin-1, GTP-binding nuclear protein Ran, ...
Authors:	Sun, Q, Chook, Y.M.
Deposit date:	2012-09-27
Release date:	2013-01-09
Last modified:	2017-07-26
Method:	X-RAY DIFFRACTION (2.2 Å)
Cite:	Nuclear export inhibition through covalent conjugation and hydrolysis of Leptomycin B by CRM1. Proc.Natl.Acad.Sci.USA, 110, 2013

4HAV

Crystal structure of CRM1 inhibitor Anguinomycin A in complex with CRM1-Ran-RanBP1
Descriptor:	Anguinomycin A, bound form, CHLORIDE ION, ...
Authors:	Sun, Q, Chook, Y.M.
Deposit date:	2012-09-27
Release date:	2013-01-09
Last modified:	2017-07-26
Method:	X-RAY DIFFRACTION (2 Å)
Cite:	Nuclear export inhibition through covalent conjugation and hydrolysis of Leptomycin B by CRM1. Proc.Natl.Acad.Sci.USA, 110, 2013

4HAX

Crystal structure of CRM1 inhibitor Ratjadone A in complex with CRM1(K579A)-Ran-RanBP1
Descriptor:	1,2-ETHANEDIOL, CHLORIDE ION, Exportin-1, ...
Authors:	Sun, Q, Chook, Y.M.
Deposit date:	2012-09-27
Release date:	2013-01-09
Last modified:	2017-07-26
Method:	X-RAY DIFFRACTION (2.28 Å)
Cite:	Nuclear export inhibition through covalent conjugation and hydrolysis of Leptomycin B by CRM1. Proc.Natl.Acad.Sci.USA, 110, 2013

4HB2

Crystal structure of CRM1-Ran-RanBP1
Descriptor:	1,2-ETHANEDIOL, CHLORIDE ION, Exportin-1, ...
Authors:	Sun, Q, Chook, Y.M.
Deposit date:	2012-09-27
Release date:	2013-01-09
Last modified:	2024-02-28
Method:	X-RAY DIFFRACTION (1.8 Å)
Cite:	Nuclear export inhibition through covalent conjugation and hydrolysis of Leptomycin B by CRM1. Proc.Natl.Acad.Sci.USA, 110, 2013

4HAU

Crystal structure of CRM1 inhibitor Ratjadone A in complex with CRM1-Ran-RanBP1
Descriptor:	1,2-ETHANEDIOL, CHLORIDE ION, Exportin-1, ...
Authors:	Sun, Q, Chook, Y.M.
Deposit date:	2012-09-27
Release date:	2013-01-09
Last modified:	2017-07-26
Method:	X-RAY DIFFRACTION (2 Å)
Cite:	Nuclear export inhibition through covalent conjugation and hydrolysis of Leptomycin B by CRM1. Proc.Natl.Acad.Sci.USA, 110, 2013

1M8Z

Crystal Structure Of A Pumilio-Homology Domain
Descriptor:	BETA-MERCAPTOETHANOL, PUMILIO 1
Authors:	Wang, X, Zamore, P.D, Hall, T.M.T.
Deposit date:	2002-07-26
Release date:	2002-09-04
Last modified:	2024-02-14
Method:	X-RAY DIFFRACTION (1.9 Å)
Cite:	Crystal structure of a Pumilio homology domain. Mol.Cell, 7, 2001

4PRU

Crystal structure of dimethyllysine hen egg-white lysozyme in complex with sclx4 at 2.2 A resolution
Descriptor:	25,26,27,28-tetrahydroxypentacyclo[19.3.1.1~3,7~.1~9,13~.1~15,19~]octacosa-1(25),3(28),4,6,9(27),10,12,15(26),16,18,21,23-dodecaene-5,11,17,23-tetrasulfonic acid, GLYCEROL, Lysozyme C
Authors:	McGovern, R.E, Lyons, J.A, Crowley, P.B.
Deposit date:	2014-03-06
Release date:	2014-11-12
Last modified:	2023-09-20
Method:	X-RAY DIFFRACTION (2.2 Å)
Cite:	Structural study of a small molecule receptor bound to dimethyllysine in lysozyme. Chem Sci, 6, 2015

4HAT

Crystal structure of CRM1 inhibitor Leptomycin B in complex with CRM1-Ran-RanBP1
Descriptor:	1,2-ETHANEDIOL, CHLORIDE ION, Exportin-1, ...
Authors:	Sun, Q, Chook, Y.M.
Deposit date:	2012-09-27
Release date:	2013-01-09
Last modified:	2017-07-26
Method:	X-RAY DIFFRACTION (1.78 Å)
Cite:	Nuclear export inhibition through covalent conjugation and hydrolysis of Leptomycin B by CRM1. Proc.Natl.Acad.Sci.USA, 110, 2013

4DF6

Crystal Structure of the inhibitor NXL104 Covalent Adduct with TB B-lactamase
Descriptor:	(2S,5R)-1-formyl-5-[(sulfooxy)amino]piperidine-2-carboxamide, Beta-lactamase, PHOSPHATE ION
Authors:	Hazra, S, Blanchard, J.
Deposit date:	2012-01-23
Release date:	2012-07-18
Last modified:	2015-06-03
Method:	X-RAY DIFFRACTION (2.29 Å)
Cite:	NXL104 irreversibly inhibits the {beta}-lactamase from Mycobacterium tuberculosis. Biochemistry, 51, 2012

4I1R

Human MALT1 (caspase-IG3) in complex with thioridazine
Descriptor:	10-{2-[(2S)-1-methylpiperidin-2-yl]ethyl}-2-(methylsulfanyl)-10H-phenothiazine, Mucosa-associated lymphoid tissue lymphoma translocation protein 1
Authors:	Schlauderer, F, Lammens, K, Hopfner, K.P.
Deposit date:	2012-11-21
Release date:	2013-08-28
Last modified:	2024-02-28
Method:	X-RAY DIFFRACTION (2.7 Å)
Cite:	Structural Analysis of Phenothiazine Derivatives as Allosteric Inhibitors of the MALT1 Paracaspase. Angew.Chem.Int.Ed.Engl., 52, 2013

1AOD

PHOSPHATIDYLINOSITOL-SPECIFIC PHOSPHOLIPASE C FROM LISTERIA MONOCYTOGENES
Descriptor:	1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE, PHOSPHATIDYLINOSITOL-SPECIFIC PHOSPHOLIPASE C
Authors:	Heinz, D.W, Moser, J.
Deposit date:	1997-07-02
Release date:	1998-01-07
Last modified:	2024-05-22
Method:	X-RAY DIFFRACTION (2.6 Å)
Cite:	Crystal structure of the phosphatidylinositol-specific phospholipase C from the human pathogen Listeria monocytogenes. J.Mol.Biol., 273, 1997

1DSP

CYTOCHROME C PEROXIDASE H175G MUTANT, IMIDAZOLE COMPLEX AT PH 7, ROOM TEMPERATURE.
Descriptor:	CYTOCHROME C PEROXIDASE, IMIDAZOLE, PROTOPORPHYRIN IX CONTAINING FE
Authors:	Hirst, J, Wilcox, S.K, Williams, P.A, McRee, D.E, Goodin, D.B.
Deposit date:	2000-01-07
Release date:	2001-03-07
Last modified:	2024-02-07
Method:	X-RAY DIFFRACTION (2.03 Å)
Cite:	Replacement of the axial histidine ligand with imidazole in cytochrome c peroxidase. 1. Effects on structure. Biochemistry, 40, 2001

1DSG

CYTOCHROME C PEROXIDASE H175G MUTANT, IMIDAZOLE COMPLEX AT PH 5, ROOM TEMPERATURE.
Descriptor:	CYTOCHROME C PEROXIDASE, IMIDAZOLE, PROTOPORPHYRIN IX CONTAINING FE
Authors:	Hirst, J, Wilcox, S.K, Williams, P.A, McRee, D.E, Goodin, D.B.
Deposit date:	2000-01-07
Release date:	2001-03-07
Last modified:	2024-02-07
Method:	X-RAY DIFFRACTION (2.56 Å)
Cite:	Replacement of the axial histidine ligand with imidazole in cytochrome c peroxidase. 1. Effects on structure. Biochemistry, 40, 2001

1DS4

CYTOCHROME C PEROXIDASE H175G MUTANT, IMIDAZOLE COMPLEX, PH 6, 100K
Descriptor:	CYTOCHROME C PEROXIDASE, IMIDAZOLE, PROTOPORPHYRIN IX CONTAINING FE
Authors:	Hirst, J, Wilcox, S.K, Williams, P.A, McRee, D.E, Goodin, D.B.
Deposit date:	2000-01-07
Release date:	2001-03-07
Last modified:	2024-02-07
Method:	X-RAY DIFFRACTION (2.02 Å)
Cite:	Replacement of the axial histidine ligand with imidazole in cytochrome c peroxidase. 1. Effects on structure. Biochemistry, 40, 2001

1DSE

CYTOCHROME C PEROXIDASE H175G MUTANT, IMIDAZOLE COMPLEX, WITH PHOSPHATE BOUND, PH 6, 100K
Descriptor:	CYTOCHROME C PEROXIDASE, IMIDAZOLE, PHOSPHATE ION, ...
Authors:	Hirst, J, Wilcox, S.K, Williams, P.A, McRee, D.E, Goodin, D.B.
Deposit date:	2000-01-07
Release date:	2001-03-07
Last modified:	2024-02-07
Method:	X-RAY DIFFRACTION (2 Å)
Cite:	Replacement of the axial histidine ligand with imidazole in cytochrome c peroxidase. 1. Effects on structure. Biochemistry, 40, 2001

1DSO

CYTOCHROME C PEROXIDASE H175G MUTANT, IMIDAZOLE COMPLEX AT PH 6, ROOM TEMPERATURE.
Descriptor:	CYTOCHROME C PEROXIDASE, IMIDAZOLE, PROTOPORPHYRIN IX CONTAINING FE
Authors:	Hirst, J, Wilcox, S.K, Williams, P.A, McRee, D.E, Goodin, D.B.
Deposit date:	2000-01-07
Release date:	2001-03-07
Last modified:	2024-02-07
Method:	X-RAY DIFFRACTION (2.03 Å)
Cite:	Replacement of the axial histidine ligand with imidazole in cytochrome c peroxidase. 1. Effects on structure. Biochemistry, 40, 2001

5OT9

Structure of the periplasmic binding protein (PBP) NocT from A.tumefaciens C58 in complex with histopine.
Descriptor:	1,2-ETHANEDIOL, Histopine, Nopaline-binding periplasmic protein
Authors:	Vigouroux, A, Morera, S.
Deposit date:	2017-08-21
Release date:	2017-12-20
Last modified:	2024-01-17
Method:	X-RAY DIFFRACTION (2.45 Å)
Cite:	Structural basis for high specificity of octopine binding in the plant pathogen Agrobacterium tumefaciens. Sci Rep, 7, 2017

5F0V

X-ray crystal structure of a thiolase from Escherichia coli at 1.8 A resolution
Descriptor:	1,2-ETHANEDIOL, Acetyl-CoA acetyltransferase
Authors:	Ithayaraja, M, Neelanjana, J, Wierenga, R, Savithri, H.S, Murthy, M.R.N.
Deposit date:	2015-11-28
Release date:	2016-07-13
Last modified:	2023-11-08
Method:	X-RAY DIFFRACTION (1.8 Å)
Cite:	Crystal structure of a thiolase from Escherichia coli at 1.8 angstrom resolution. Acta Crystallogr.,Sect.F, 72, 2016

5F38

X-ray crystal structure of a thiolase from Escherichia coli at 1.8 A resolution
Descriptor:	1,2-ETHANEDIOL, Acetyl-CoA acetyltransferase, COENZYME A, ...
Authors:	Ithayaraja, M, Neelanjana, J, Wierenga, R, Savithri, H.S, Murthy, M.R.N.
Deposit date:	2015-12-02
Release date:	2016-07-13
Last modified:	2023-11-08
Method:	X-RAY DIFFRACTION (1.9 Å)
Cite:	Crystal structure of a thiolase from Escherichia coli at 1.8 angstrom resolution. Acta Crystallogr.,Sect.F, 72, 2016

1RSG

Crystal structure of the polyamine oxidase Fms1 from yeast
Descriptor:	FLAVIN-ADENINE DINUCLEOTIDE, FMS1 protein
Authors:	Huang, Q, Liu, Q, Hao, Q.
Deposit date:	2003-12-09
Release date:	2005-02-15
Last modified:	2011-07-13
Method:	X-RAY DIFFRACTION (1.9 Å)
Cite:	Crystal structures of fms1 and its complex with spermine reveal substrate specificity. J.Mol.Biol., 348, 2005

1TB4

Crystal Structure of Aspartate-Semialdehyde Dehydrogenase From Haemophilus influenzae with a Bound Periodate
Descriptor:	Aspartate-semialdehyde dehydrogenase, PERIODATE
Authors:	Viola, R.E.
Deposit date:	2004-05-19
Release date:	2004-12-07
Last modified:	2024-02-14
Method:	X-RAY DIFFRACTION (2.15 Å)
Cite:	Structural basis for discrimination between oxyanion substrates or inhibitors in aspartate-beta-semialdehyde dehydrogenase. Acta Crystallogr.,Sect.D, 60, 2004

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