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1B8Y
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X-RAY STRUCTURE OF HUMAN STROMELYSIN CATALYTIC DOMAIN COMPLEXED WITH NON-PEPTIDE INHIBITORS: IMPLICATIONS FOR INHIBITOR SELECTIVITY
Descriptor:PROTEIN (STROMELYSIN-1), ZINC ION, CALCIUM ION, ...
Authors:Pavlovsky, A.G., Williams, M.G., Ye, Q.-Z., Ortwine, D.F., Purchase II, C.F., White, A.D., Dhanaraj, V., Roth, B.D., Johnson, L.L., Hupe, D., Humblet, C., Blundell, T.L.
Deposit date:1999-02-03
Release date:1999-08-31
Last modified:2018-01-31
Method:X-RAY DIFFRACTION (2 Å)
Cite:X-ray structure of human stromelysin catalytic domain complexed with nonpeptide inhibitors: implications for inhibitor selectivity.
Protein Sci., 8, 1999
1CAQ
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X-RAY STRUCTURE OF HUMAN STROMELYSIN CATALYTIC DOMAIN COMPLEXES WITH NON-PEPTIDE INHIBITORS: IMPLICATION FOR INHIBITOR SELECTIVITY
Descriptor:PROTEIN (STROMELYSIN-1), ZINC ION, CALCIUM ION, ...
Authors:Pavlovsky, A.G., Williams, M.G., Ye, Q.-Z., Ortwine, D.F., Purchase II, C.F., White, A.D., Dhanaraj, V., Roth, B.D., Johnson, L.L., Hupe, D., Humblet, C., Blundell, T.L.
Deposit date:1999-02-23
Release date:1999-07-07
Last modified:2018-01-31
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:X-ray structure of human stromelysin catalytic domain complexed with nonpeptide inhibitors: implications for inhibitor selectivity.
Protein Sci., 8, 1999
1CIZ
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X-RAY STRUCTURE OF HUMAN STROMELYSIN CATALYTIC DOMAIN COMPLEXES WITH NON-PEPTIDE INHIBITORS: IMPLICATION FOR INHIBITOR SELECTIVITY
Descriptor:PROTEIN (STROMELYSIN-1), ZINC ION, CALCIUM ION, ...
Authors:Pavlovsky, A.G., Williams, M.G., Ye, Q.-Z., Ortwine, D.F., Purchase II, C.F., White, A.D., Dhanaraj, V., Roth, B.D., Johnson, L.L., Hupe, D., Humblet, C., Blundell, T.L.
Deposit date:1999-04-06
Release date:1999-09-01
Last modified:2018-01-31
Method:X-RAY DIFFRACTION (1.64 Å)
Cite:X-ray structure of human stromelysin catalytic domain complexed with nonpeptide inhibitors: implications for inhibitor selectivity.
Protein Sci., 8, 1999
3PWK
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CRYSTAL STRUCTURE OF ASPARTATE BETA-SEMIALDEHIDE DEHYDROGENASE FROM STREPTOCOCCUS PNEUMONIAE WITH 2',5'-ADENOSINE DIPHOSPHATE AND D-2-AMINOADIPATE
Descriptor:Aspartate-semialdehyde dehydrogenase, 5'-O-MONOPHOSPHORYLADENYLYL(2'->5')ADENYLYL(2'->5')ADENOSINE, trans-cyclohexane-1,4-dicarboxylic acid, ...
Authors:Pavlovsky, A.G., Viola, R.E.
Deposit date:2010-12-08
Release date:2012-01-04
Last modified:2017-11-08
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Structural Characterization of Inhibitors with Selectivity against Members of a Homologous Enzyme Family.
Chem.Biol.Drug Des., 79, 2012
3PWS
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CRYSTAL STRUCTURE OF ASPARTATE BETA-SEMIALDEHIDE DEHYDROGENASE FROM STREPTOCOCCUS PNEUMONIAE WITH 2',5'-ADENOSINE DIPHOSPHATE AND D-2-AMINOADIPATE
Descriptor:Aspartate-semialdehyde dehydrogenase, (2R)-2-aminohexanedioic acid, SODIUM ION, ...
Authors:Pavlovsky, A.G., Viola, R.E.
Deposit date:2010-12-08
Release date:2012-01-04
Last modified:2017-11-08
Method:X-RAY DIFFRACTION (2 Å)
Cite:Structural Characterization of Inhibitors with Selectivity against Members of a Homologous Enzyme Family.
Chem.Biol.Drug Des., 79, 2012
3PYL
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CRYSTAL STRUCTURE OF ASPARTATE BETA-SEMIALDEHIDE DEHYDROGENASE FROM STREPTOCOCCUS PNEUMONIAE WITH D-2,3-DIAMINOPROPIONATE
Descriptor:Aspartate-semialdehyde dehydrogenase, 3-amino-D-alanine
Authors:Pavlovsky, A.G., Liu, X., Faehnle, C.R., Potente, N., Viola, R.E.
Deposit date:2010-12-13
Release date:2012-01-04
Last modified:2014-10-15
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Structural Characterization of Inhibitors with Selectivity against Members of a Homologous Enzyme Family.
Chem.Biol.Drug Des., 79, 2012
3PYX
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CRYSTALS STRUCTURE OF ASPARTATE BETA-SEMIALDEHYDE DEHYDROGENASE COMPLEX WITH NADP AND 2-AMINOTEREPHTHALATE
Descriptor:Aspartate-semialdehyde dehydrogenase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, SODIUM ION, ...
Authors:Pavlovsky, A.G., Viola, R.E.
Deposit date:2010-12-13
Release date:2012-01-04
Last modified:2017-11-08
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Structural Characterization of Inhibitors with Selectivity against Members of a Homologous Enzyme Family.
Chem.Biol.Drug Des., 79, 2012
3PZB
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CRYSTALS STRUCTURE OF ASPARTATE BETA-SEMIALDEHYDE DEHYDROGENASE COMPLEX WITH NADP AND D-2,3-DIAMINOPROPIONATE
Descriptor:Aspartate-semialdehyde dehydrogenase, 3-amino-D-alanine, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
Authors:Pavlovsky, A.G., Viola, R.E.
Deposit date:2010-12-14
Release date:2012-01-04
Last modified:2017-11-08
Method:X-RAY DIFFRACTION (2 Å)
Cite:Structural Characterization of Inhibitors with Selectivity against Members of a Homologous Enzyme Family.
Chem.Biol.Drug Des., 79, 2012
3PZR
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CRYSTALS STRUCTURE OF ASPARTATE BETA-SEMIALDEHYDE DEHYDROGENASE FROM VIBRIO CHOLERAE WITH NADP AND PRODUCT OF S-CARBAMOYL-L-CYSTEINE
Descriptor:Aspartate-semialdehyde dehydrogenase, CYSTEINE, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
Authors:Pavlovsky, A.G., Potente, N., Viola, R.E.
Deposit date:2010-12-14
Release date:2012-01-04
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Structural Characterization of Inhibitors with Selectivity against Members of a Homologous Enzyme Family.
Chem.Biol.Drug Des., 79, 2012
3Q0E
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CRYSTALS STRUCTURE OF ASPARTATE BETA-SEMIALDEHYDE DEHYDROGENASE FROM VIBRIO CHOLERAE WITH PRODUCT OF S-ALLYL-L-CYSTEINE SULFOXIDE
Descriptor:Aspartate-semialdehyde dehydrogenase, CYSTEINE, SULFATE ION, ...
Authors:Pavlovsky, A.G., Liu, X., Viola, R.E.
Deposit date:2010-12-15
Release date:2012-02-22
Last modified:2014-10-08
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Structural characterization of inhibitors with selectivity against members of a homologous enzyme family.
Chem.Biol.Drug Des., 79, 2012
3Q11
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CRYSTALS STRUCTURE OF ASPARTATE BETA-SEMIALDEHYDE DEHYDROGENASE FROM STREPTOCOCCUS PNEUMONIAE WITH NADP AND ASPARTYL BETA-DIFLUOROPHOSPHONATE
Descriptor:Aspartate-semialdehyde dehydrogenase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, 5,5-difluoro-4-oxo-5-phosphono-D-norvaline, ...
Authors:Pavlovsky, A.G., Viola, R.E., Faehnle, C.R.
Deposit date:2010-12-16
Release date:2012-01-04
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Structural Characterization of Inhibitors with Selectivity against Members of a Homologous Enzyme Family.
Chem.Biol.Drug Des., 79, 2012
3Q1L
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CRYSTALS STRUCTURE OF ASPARTATE BETA-SEMIALDEHYDE DEHYDROGENASE FROM STREPTOCOCCUS PNEUMONIAE WITH CYSTEAMINE BOUND COVALENTLY TO CYS 128
Descriptor:Aspartate beta-semialdehyde dehydrogenase, 2-AMINO-ETHANETHIOL
Authors:Pavlovsky, A.G., Viola, R.E.
Deposit date:2010-12-17
Release date:2012-01-04
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Structural Characterization of Inhibitors with Selectivity against Members of a Homologous Enzyme Family.
Chem.Biol.Drug Des., 79, 2012
4R3N
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CRYSTAL STRUCTURE OF THE TERNARY COMPLEX OF SP-ASADH WITH NADP AND 1,2,3-BENZENETRICARBOXYLIC ACID
Descriptor:Aspartate-semialdehyde dehydrogenase, SODIUM ION, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
Authors:Pavlovsky, A.G., Viola, R.E.
Deposit date:2014-08-16
Release date:2014-12-10
Last modified:2017-11-22
Method:X-RAY DIFFRACTION (1.35 Å)
Cite:A cautionary tale of structure-guided inhibitor development against an essential enzyme in the aspartate-biosynthetic pathway.
Acta Crystallogr.,Sect.D, 70, 2014
4R3W
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CRYSTAL STRUCTURE ANALYSIS OF THE 1,2,3-TRICARBOXYLATE BENZOIC ACID BOUND TO SP-ASADH-2'5'-ADP COMPLEX
Descriptor:Aspartate-semialdehyde dehydrogenase, SODIUM ION, benzene-1,2,3-tricarboxylic acid, ...
Authors:Pavlovsky, A.G., Viola, R.E.
Deposit date:2014-08-18
Release date:2014-12-10
Last modified:2017-11-22
Method:X-RAY DIFFRACTION (1.91 Å)
Cite:A cautionary tale of structure-guided inhibitor development against an essential enzyme in the aspartate-biosynthetic pathway.
Acta Crystallogr.,Sect.D, 70, 2014
4R41
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COMPLEX CRYSTAL STRUCTURE OF 4-NITRO-2-PHOSPHONO-BENZOIC ACID WITH SP-ASPARTATE-SEMIALDEHYDE DEHYDROGENASE AND NICOTINAMIDE-DINUCLEOTIDE
Descriptor:Aspartate-semialdehyde dehydrogenase, 4-nitro-2-phosphonobenzoic acid, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
Authors:Pavlovsky, A.G., Viola, R.E.
Deposit date:2014-08-18
Release date:2014-12-10
Last modified:2017-11-22
Method:X-RAY DIFFRACTION (1.61 Å)
Cite:A cautionary tale of structure-guided inhibitor development against an essential enzyme in the aspartate-biosynthetic pathway.
Acta Crystallogr.,Sect.D, 70, 2014
4R4J
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CRYSTAL STRUCTURE OF COMPLEX SP_ASADH WITH 3-CARBOXYPROPYL-PHTHALIC ACID AND NICOTINAMIDE ADENINE DINUCLEOTIDE PHOSPHATE
Descriptor:Aspartate-semialdehyde dehydrogenase, 3-(3-carboxypropyl)benzene-1,2-dicarboxylic acid, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
Authors:Pavlovsky, A.G., Thangavelu, B., Bhansali, P., Viola, R.E.
Deposit date:2014-08-19
Release date:2014-12-10
Last modified:2017-11-22
Method:X-RAY DIFFRACTION (1.51 Å)
Cite:A cautionary tale of structure-guided inhibitor development against an essential enzyme in the aspartate-biosynthetic pathway.
Acta Crystallogr.,Sect.D, 70, 2014
4R51
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CRYSTAL COMPLEX STRUCTURE OF SP-ASPARTATE-SEMIALDEHYDE-DEHYDROGENASE WITH NICOTINAMIDE ADENINE DINUCLEOTIDE PHOSPHATE AND PHTHALIC ACID
Descriptor:Aspartate-semialdehyde dehydrogenase, SODIUM ION, PHTHALIC ACID, ...
Authors:Pavlovsky, A.G., Viola, R.E.
Deposit date:2014-08-20
Release date:2014-12-10
Last modified:2017-11-22
Method:X-RAY DIFFRACTION (1.81 Å)
Cite:A cautionary tale of structure-guided inhibitor development against an essential enzyme in the aspartate-biosynthetic pathway.
Acta Crystallogr.,Sect.D, 70, 2014
4R54
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COMPLEX CRYSTAL STRUCTURE OF SP-ASPARTATE-SEMIALDEHYDE-DEHYDROGENASE WITH 3-CARBOXY-ETHYL-PHTHALIC ACID
Descriptor:Aspartate-semialdehyde dehydrogenase, SODIUM ION, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
Authors:Pavlovsky, A.G., Viola, R.E.
Deposit date:2014-08-20
Release date:2014-12-10
Last modified:2017-11-22
Method:X-RAY DIFFRACTION (1.81 Å)
Cite:A cautionary tale of structure-guided inhibitor development against an essential enzyme in the aspartate-biosynthetic pathway.
Acta Crystallogr.,Sect.D, 70, 2014
4R5H
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CRYSTAL STRUCTURE OF SP-ASPARTATE-SEMIALDEHYDE-DEHYDROGENASE WITH NICOTINAMIDE-ADENINE-DINUCLEOTIDE-PHOSPHATE AND 3-CARBOXY-PROPENYL-PHTHALIC ACID
Descriptor:Aspartate-semialdehyde dehydrogenase, 1,2-ETHANEDIOL, SODIUM ION, ...
Authors:Pavlovsky, A.G., Thangavelu, B., Bhansali, P., Viola, R.E.
Deposit date:2014-08-21
Release date:2014-12-10
Last modified:2017-11-22
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:A cautionary tale of structure-guided inhibitor development against an essential enzyme in the aspartate-biosynthetic pathway.
Acta Crystallogr.,Sect.D, 70, 2014
4R5M
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CRYSTAL STRUCTURE OF VC-ASPARTATE BETA-SEMIALDEHYDE-DEHYDROGENASE WITH NADP AND 4-NITRO-2-PHOSPHONO-BENZOIC ACID
Descriptor:Aspartate-semialdehyde dehydrogenase 1, SODIUM ION, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
Authors:Pavlovsky, A.G., Thangavelu, B., Bhansali, P., Viola, R.E.
Deposit date:2014-08-21
Release date:2014-12-10
Last modified:2014-12-31
Method:X-RAY DIFFRACTION (1.89 Å)
Cite:A cautionary tale of structure-guided inhibitor development against an essential enzyme in the aspartate-biosynthetic pathway.
Acta Crystallogr.,Sect.D, 70, 2014
1QIA
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CRYSTAL STRUCTURE OF STROMELYSIN CATALYTIC DOMAIN
Descriptor:STROMELYSIN-1, ZINC ION, CALCIUM ION
Authors:Williams, M.G., Ye, Q.-Z., Molina, F., Johnson, L.L., Ortwine, D.F., Pavlovsky, A.G., Rubin, J.R., Skeean, R.W., White, A.D., Blundell, T.L., Humblet, C., Hupe, D.J., Dhanaraj, V.
Deposit date:1999-06-11
Release date:2003-02-11
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (2 Å)
Cite:X-ray structure of human stromelysin catalytic domain complexed with nonpeptide inhibitors: implications for inhibitor selectivity
Protein Sci., 8, 1999
1QIC
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CRYSTAL STRUCTURE OF STROMELYSIN CATALYTIC DOMAIN
Descriptor:PROTEIN (STROMELYSIN-1), ZINC ION, CALCIUM ION
Authors:Williams, M.G., Ye, Q.-Z., Molina, F., Johnson, L.L., Ortwine, D.F., Pavlovsky, A.G., Rubin, J.R., Skeean, R.W., White, A.D., Blundell, T.L., Humblet, C., Hupe, D.J., Dhanaraj, V.
Deposit date:1999-06-11
Release date:2003-02-11
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (2 Å)
Cite:X-ray structure of human stromelysin catalytic domain complexed with nonpeptide inhibitors: implications for inhibitor selectivity
Protein Sci., 8, 1999
2OW9
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CRYSTAL STRUCTURE ANALYSIS OF THE MMP13 CATALYTIC DOMAIN IN COMPLEX WITH SPECIFIC INHIBITOR
Descriptor:Collagenase 3, ZINC ION, CALCIUM ION, ...
Authors:Pavlovsky, A.G.
Deposit date:2007-02-15
Release date:2007-02-27
Last modified:2017-10-18
Method:X-RAY DIFFRACTION (1.74 Å)
Cite:Discovery and characterization of a novel inhibitor of matrix metalloprotease-13 that reduces cartilage damage in vivo without joint fibroplasia side effects.
J.Biol.Chem., 282, 2007
1GOY
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HYDROLASE(ENDORIBONUCLEASE)RIBONUCLEASE BI(G SPECIFIC ENDONUCLEASE) (E.C.3.1.27.-) COMPLEXED WITH GUANOSINE-3'-PHOSPHATE (3'-GMP)
Descriptor:RIBONUCLEASE, GUANOSINE-3'-MONOPHOSPHATE, SULFATE ION
Authors:Polyakov, K.M., Lebedev, A.A., Pavlovsky, A.G., Sanishvili, R.G., Dodson, G.G.
Deposit date:2001-10-26
Release date:2001-11-29
Last modified:2017-07-12
Method:X-RAY DIFFRACTION (2 Å)
Cite:The Structure of Substrate-Free Microbial Ribonuclease Binase and of its Complexes with 3'Gmp and Sulfate Ions
Acta Crystallogr.,Sect.D, 58, 2002
1GOV
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RIBONUCLEASE BI(G SPECIFIC ENDONUCLEASE) COMPLEXED WITH SULFATE IONS
Descriptor:RIBONUCLEASE, SULFATE ION
Authors:Polyakov, K.M., Lebedev, A.A., Pavlovsky, A.G., Sanishvili, R.G., Dodson, G.G.
Deposit date:2001-10-26
Release date:2001-11-29
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2 Å)
Cite:The Structure of Substrate-Free Microbial Ribonuclease Binase and of its Complexes with 3'Gmp and Sulfate Ions
Acta Crystallogr.,Sect.D, 58, 2002
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