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2HAL
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AN EPISULFIDE CATION (THIIRANIUM RING) TRAPPED IN THE ACTIVE SITE OF HAV 3C PROTEINASE INACTIVATED BY PEPTIDE-BASED KETONE INHIBITORS
Descriptor:Hepatitis A Protease 3C, N-ACETYL-LEUCYL-PHENYLALANYL-PHENYLALANYL-GLUTAMATE-FLUOROMETHYLKETONE INHIBITOR, N-[(BENZYLOXY)CARBONYL]-L-ALANINE
Authors:Yin, J., Cherney, M.M., Bergmann, E.M., James, M.N.
Deposit date:2006-06-13
Release date:2006-08-08
Last modified:2012-12-12
Method:X-RAY DIFFRACTION (1.35 Å)
Cite:An Episulfide Cation (Thiiranium Ring) Trapped in the Active Site of HAV 3C Proteinase Inactivated by Peptide-based Ketone Inhibitors.
J.Mol.Biol., 361, 2006
1DM0
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SHIGA TOXIN
Descriptor:SHIGA TOXIN A SUBUNIT, SHIGA TOXIN B SUBUNIT
Authors:Fraser, M.E., Chernaia, M.M., Kozlov, Y.V., James, M.N.
Deposit date:1999-12-13
Release date:1999-12-30
Last modified:2017-10-04
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Crystal structure of the holotoxin from Shigella dysenteriae at 2.5 A resolution.
Nat.Struct.Biol., 1, 1994
2A5A
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CRYSTAL STRUCTURE OF UNBOUND SARS CORONAVIRUS MAIN PEPTIDASE IN THE SPACE GROUP C2
Descriptor:3C-like peptidase, CHLORIDE ION, 1,2-ETHANEDIOL
Authors:Lee, T.-W., Cherney, M.M., Huitema, C., Liu, J., James, K.E., Powers, J.C., Eltis, L.D., James, M.N.
Deposit date:2005-06-30
Release date:2005-10-25
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.08 Å)
Cite:Crystal Structures of the Main Peptidase from the SARS Coronavirus Inhibited by a Substrate-like Aza-peptide Epoxide
J.Mol.Biol., 353, 2005
2A5I
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CRYSTAL STRUCTURES OF SARS CORONAVIRUS MAIN PEPTIDASE INHIBITED BY AN AZA-PEPTIDE EPOXIDE IN THE SPACE GROUP C2
Descriptor:3C-like peptidase, (5S,8S,14R)-ETHYL 11-(3-AMINO-3-OXOPROPYL)-8-BENZYL-14-HYDROXY-5-ISOBUTYL-3,6,9,12-TETRAOXO-1-PHENYL-2-OXA-4,7,10,11-TETRAAZAPENTADECAN-15-OATE, 1,2-ETHANEDIOL, ...
Authors:Lee, T.-W., Cherney, M.M., Huitema, C., Liu, J., James, K.E., Powers, J.C., Eltis, L.D., James, M.N.
Deposit date:2005-06-30
Release date:2005-10-25
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.88 Å)
Cite:Crystal Structures of the Main Peptidase from the SARS Coronavirus Inhibited by a Substrate-like Aza-peptide Epoxide
J.Mol.Biol., 353, 2005
2A5K
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CRYSTAL STRUCTURES OF SARS CORONAVIRUS MAIN PEPTIDASE INHIBITED BY AN AZA-PEPTIDE EPOXIDE IN SPACE GROUP P212121
Descriptor:3C-like peptidase, (5S,8S,14R)-ETHYL 11-(3-AMINO-3-OXOPROPYL)-8-BENZYL-14-HYDROXY-5-ISOBUTYL-3,6,9,12-TETRAOXO-1-PHENYL-2-OXA-4,7,10,11-TETRAAZAPENTADECAN-15-OATE
Authors:Lee, T.-W., Cherney, M.M., Huitema, C., Liu, J., James, K.E., Powers, J.C., Eltis, L.D., James, M.N.
Deposit date:2005-06-30
Release date:2005-10-25
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Crystal Structures of the Main Peptidase from the SARS Coronavirus Inhibited by a Substrate-like Aza-peptide Epoxide
J.Mol.Biol., 353, 2005
1JAK
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STREPTOMYCES PLICATUS BETA-N-ACETYLHEXOSAMINIDASE IN COMPLEX WITH (2R,3R,4S,5R)-2-ACETAMIDO-3,4-DIHYDROXY-5-HYDROXYMETHYL-PIPERIDINIUM CHLORIDE (IFG)
Descriptor:Beta-N-acetylhexosaminidase, SULFATE ION, CHLORIDE ION, ...
Authors:Mark, B.L., Vocadlo, D.J., Zhao, D., Knapp, S., Withers, S.G., James, M.N.
Deposit date:2001-05-30
Release date:2001-11-21
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Biochemical and structural assessment of the 1-N-azasugar GalNAc-isofagomine as a potent family 20 beta-N-acetylhexosaminidase inhibitor.
J.Biol.Chem., 276, 2001
2H6M
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AN EPISULFIDE CATION (THIIRANIUM RING) TRAPPED IN THE ACTIVE SITE OF HAV 3C PROTEINASE INACTIVATED BY PEPTIDE-BASED KETONE INHIBITORS
Descriptor:Picornain 3C, N-ACETYL-LEUCYL-ALANYL-ALANYL-(N,N-DIMETHYL)-GLUTAMINE-(1,4-DIOXO-3,4-DIHYDRO-1H-PHTHALAZIN-2-YL)METHYLKETONE INHIBITOR, N-[(BENZYLOXY)CARBONYL]-L-ALANINE
Authors:Yin, J., Cherney, M.M., Bergmann, E.M., James, M.N.
Deposit date:2006-05-31
Release date:2006-08-08
Last modified:2012-12-12
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:An episulfide cation (thiiranium ring) trapped in the active site of HAV 3C proteinase inactivated by peptide-based ketone inhibitors.
J.Mol.Biol., 361, 2006
4DGI
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STRUCTURE OF POM1 FAB FRAGMENT COMPLEXED WITH HUMAN PRPC FRAGMENT 120-230
Descriptor:Major prion protein, POM1 Fab Heavy chain, POM1 Fab Light chain, ...
Authors:Baral, P.K., Wieland, B., Swayampakula, M., James, M.N.
Deposit date:2012-01-26
Release date:2012-10-31
Last modified:2013-01-23
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Structural studies on the folded domain of the human prion protein bound to the Fab fragment of the antibody POM1.
Acta Crystallogr.,Sect.D, 68, 2012
2H9H
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AN EPISULFIDE CATION (THIIRANIUM RING) TRAPPED IN THE ACTIVE SITE OF HAV 3C PROTEINASE INACTIVATED BY PEPTIDE-BASED KETONE INHIBITORS
Descriptor:Hepatitis A virus protease 3C, Three residue peptide, N-[(BENZYLOXY)CARBONYL]-L-ALANINE
Authors:Yin, J., Cherney, M.M., Bergmann, E.M., James, M.N.
Deposit date:2006-06-09
Release date:2006-08-08
Last modified:2012-12-12
Method:X-RAY DIFFRACTION (1.39 Å)
Cite:An Episulfide Cation (Thiiranium Ring) Trapped in the Active Site of HAV 3C Proteinase Inactivated by Peptide-based Ketone Inhibitors.
J.Mol.Biol., 361, 2006
1CT2
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CRYSTAL STRUCTURE OF THE OMTKY3 P1 VARIANT OMTKY3-THR18I IN COMPLEX WITH SGPB
Descriptor:PROTEINASE B, OVOMUCOID INHIBITOR
Authors:Bateman, K.S., Anderson, S., Lu, W., Qasim, M.A., Laskowski Jr., M., James, M.N.
Deposit date:1999-08-18
Release date:2000-01-12
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:Deleterious effects of beta-branched residues in the S1 specificity pocket of Streptomyces griseus proteinase B (SGPB): crystal structures of the turkey ovomucoid third domain variants Ile18I, Val18I, Thr18I, and Ser18I in complex with SGPB.
Protein Sci., 9, 2000
1F32
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CRYSTAL STRUCTURE OF ASCARIS PEPSIN INHIBITOR-3
Descriptor:MAJOR PEPSIN INHIBITOR PI-3
Authors:Ng, K.K., Petersen, J.F., Cherney, M.M., Garen, C., James, M.N.
Deposit date:2000-05-31
Release date:2001-02-01
Last modified:2018-04-04
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Structural basis for the inhibition of porcine pepsin by Ascaris pepsin inhibitor-3.
Nat.Struct.Biol., 7, 2000
1F34
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CRYSTAL STRUCTURE OF ASCARIS PEPSIN INHIBITOR-3 BOUND TO PORCINE PEPSIN
Descriptor:PEPSIN A, MAJOR PEPSIN INHIBITOR PI-3, (4S)-2-METHYL-2,4-PENTANEDIOL
Authors:Ng, K.K., Petersen, J.F., Cherney, M.M., Garen, C., James, M.N.
Deposit date:2000-05-31
Release date:2001-02-01
Last modified:2018-04-04
Method:X-RAY DIFFRACTION (2.45 Å)
Cite:Structural basis for the inhibition of porcine pepsin by Ascaris pepsin inhibitor-3.
Nat.Struct.Biol., 7, 2000
1JK7
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CRYSTAL STRUCTURE OF THE TUMOR-PROMOTER OKADAIC ACID BOUND TO PROTEIN PHOSPHATASE-1
Descriptor:SERINE/THREONINE PROTEIN PHOSPHATASE PP1-GAMMA CATALYTIC SUBUNIT, MANGANESE (II) ION, SULFATE ION, ...
Authors:Maynes, J.T., Bateman, K.S., Cherney, M.M., Das, A.K., James, M.N.
Deposit date:2001-07-11
Release date:2001-08-15
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Crystal structure of the tumor-promoter okadaic acid bound to protein phosphatase-1.
J.Biol.Chem., 276, 2001
1KHV
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CRYSTAL STRUCTURE OF RABBIT HEMORRHAGIC DISEASE VIRUS RNA-DEPENDENT RNA POLYMERASE COMPLEXED WITH LU3+
Descriptor:RNA-DIRECTED RNA POLYMERASE, LUTETIUM (III) ION
Authors:Ng, K.K., Cherney, M.M., Vazquez, A.L., Machin, A., Alonso, J.M., Parra, F., James, M.N.
Deposit date:2001-12-01
Release date:2002-01-16
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Crystal structures of active and inactive conformations of a caliciviral RNA-dependent RNA polymerase.
J.Biol.Chem., 277, 2002
1KHW
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CRYSTAL STRUCTURE OF RABBIT HEMORRHAGIC DISEASE VIRUS RNA-DEPENDENT RNA POLYMERASE COMPLEXED WITH MN2+
Descriptor:RNA-DIRECTED RNA POLYMERASE, MANGANESE (II) ION
Authors:Ng, K.K., Cherney, M.M., Vazquez, A.L., Machin, A., Alonso, J.M., Parra, F., James, M.N.
Deposit date:2001-12-01
Release date:2002-01-16
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Crystal structures of active and inactive conformations of a caliciviral RNA-dependent RNA polymerase.
J.Biol.Chem., 277, 2002
1MIQ
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CRYSTAL STRUCTURE OF PROPLASMEPSIN FROM THE HUMAN MALARIAL PATHOGEN PLASMODIUM VIVAX
Descriptor:plasmepsin
Authors:Bernstein, N.K., Cherney, M.M., Yowell, C.A., Dame, J.B., James, M.N.
Deposit date:2002-08-23
Release date:2002-09-18
Last modified:2018-01-31
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structural insights into the activation of P. vivax plasmepsin.
J.Mol.Biol., 329, 2003
1OYV
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CRYSTAL STRUCTURE OF TOMATO INHIBITOR-II IN A TERNARY COMPLEX WITH SUBTILISIN CARLSBERG
Descriptor:Subtilisin Carlsberg, Wound-induced proteinase inhibitor-II, CALCIUM ION
Authors:Barrette-Ng, I.H., Ng, K.K., Cherney, M.M., Pearce, G., Ryan, C.A., James, M.N.
Deposit date:2003-04-07
Release date:2003-07-15
Last modified:2017-10-11
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structural basis of inhibition revealed by a 1:2 complex of the two-headed tomato inhibitor-II and subtilisin Carlsberg
J.Biol.Chem., 278, 2003
1Q74
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THE CRYSTAL STRUCTURE OF 1D-MYO-INOSITOL 2-ACETAMIDO-2-DEOXY-ALPHA-D-GLUCOPYRANOSIDE DEACETYLASE (MSHB)
Descriptor:1D-myo-inositol 2-acetamido-2-deoxy-alpha-D-glucopyranoside Deacetylase (MshB), ZINC ION, 2-{2-[2-(2-{2-[2-(2-ETHOXY-ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)-ETHOXY]-ETHOXY}-ETHANOL
Authors:Maynes, J.T., Garen, C., Cherney, M.M., Newton, G., Arad, D., Av-Gay, Y., Fahey, R.C., James, M.N., TB Structural Genomics Consortium (TBSGC)
Deposit date:2003-08-15
Release date:2003-12-02
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:The Crystal Structure of 1-D-myo-Inositol 2-Acetamido-2-deoxy-alpha-D-glucopyranoside Deacetylase (MshB) from Mycobacterium tuberculosis Reveals a Zinc Hydrolase with a Lactate Dehydrogenase Fold.
J.Biol.Chem., 278, 2003
1S2B
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STRUCTURE OF SCP-B THE FIRST MEMBER OF THE EQOLISIN FAMILY OF PEPTIDASES TO HAVE ITS STRUCTURE DETERMINED
Descriptor:Scytalidopepsin B
Authors:Fujinaga, M., Cherney, M.M., Oyama, H., Oda, K., James, M.N.
Deposit date:2004-01-08
Release date:2004-04-27
Last modified:2011-11-16
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:The molecular structure and catalytic mechanism of a novel carboxyl peptidase from Scytalidium lignicolum
Proc.Natl.Acad.Sci.USA, 101, 2004
1S2K
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STRUCTURE OF SCP-B A MEMBER OF THE EQOLISIN FAMILY OF PEPTIDASES IN A COMPLEX WITH A TRIPEPTIDE ALA-ILE-HIS
Descriptor:Scytalidopepsin B, Ala-Ile-His tripeptide, TYROSINE
Authors:Fujinaga, M., Cherney, M.M., Oyama, H., Oda, K., James, M.N.
Deposit date:2004-01-08
Release date:2004-04-27
Last modified:2018-04-04
Method:X-RAY DIFFRACTION (2 Å)
Cite:The molecular structure and catalytic mechanism of a novel carboxyl peptidase from Scytalidium lignicolum
Proc.Natl.Acad.Sci.USA, 101, 2004
1Y0H
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STRUCTURE OF RV0793 FROM MYCOBACTERIUM TUBERCULOSIS
Descriptor:hypothetical protein Rv0793, ACETATE ION
Authors:Lemieux, M.J., Ference, C., Cherney, M.M., Wang, M., Garen, C., James, M.N., TB Structural Genomics Consortium (TBSGC)
Deposit date:2004-11-15
Release date:2004-12-28
Last modified:2017-10-11
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:The crystal structure of Rv0793, a hypothetical monooxygenase from M. tuberculosis
J.STRUCT.FUNCT.GENOM., 6, 2005
1Y30
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X-RAY CRYSTAL STRUCTURE OF MYCOBACTERIUM TUBERCULOSIS PYRIDOXINE 5'-PHOSPHATE OXIDASE COMPLEXED WITH FLAVIN MONONUCLEOTIDE AT 2.2 A RESOLUTION
Descriptor:hypothetical protein Rv1155, FLAVIN MONONUCLEOTIDE
Authors:Biswal, B.K., Cherney, M.M., Wang, M., Garen, C., James, M.N., TB Structural Genomics Consortium (TBSGC)
Deposit date:2004-11-23
Release date:2005-08-30
Last modified:2017-10-11
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Structures of Mycobacterium tuberculosispyridoxine 5'-phosphate oxidase and its complexes with flavin mononucleotide and pyridoxal 5'-phosphate.
Acta Crystallogr.,Sect.D, 61, 2005
2AQ6
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X-RAY CRYSTAL STRUCTURE OF MYCOBACTERIUM TUBERCULOSIS PYRIDOXINE 5'-PHOSPHATE OXIDASE COMPLEXED WITH PYRIDOXAL 5'-PHOSPHATE AT 1.7 A RESOLUTION
Descriptor:PYRIDOXINE 5'-PHOSPHATE OXIDASE, PYRIDOXAL-5'-PHOSPHATE
Authors:Biswal, B.K., Cherney, M.M., Wang, M., Garen, C., James, M.N., TB Structural Genomics Consortium (TBSGC)
Deposit date:2005-08-17
Release date:2005-08-30
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Structures of Mycobacterium tuberculosispyridoxine 5'-phosphate oxidase and its complexes with flavin mononucleotide and pyridoxal 5'-phosphate.
Acta Crystallogr.,Sect.D, 61, 2005
2ASF
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CRYSTAL STRUCTURE OF THE CONSERVED HYPOTHETICAL PROTEIN RV2074 FROM MYCOBACTERIUM TUBERCULOSIS 1.6 A
Descriptor:Hypothetical protein Rv2074, SODIUM ION, CITRIC ACID
Authors:Biswal, B.K., Au, K., Cherney, M.M., Garen, C., James, M.N., TB Structural Genomics Consortium (TBSGC)
Deposit date:2005-08-23
Release date:2005-10-11
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:The molecular structure of Rv2074, a probable pyridoxine 5'-phosphate oxidase from Mycobacterium tuberculosis, at 1.6 angstroms resolution.
Acta Crystallogr.,Sect.F, 62, 2006
2BCD
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X-RAY CRYSTAL STRUCTURE OF PROTEIN PHOSPHATASE-1 WITH THE MARINE TOXIN MOTUPORIN BOUND
Descriptor:Serine/threonine protein phosphatase PP1-gamma catalytic subunit, MOTUPORIN, BETA-MERCAPTOETHANOL, ...
Authors:Maynes, J.T., Luu, H.A., Cherney, M.M., Andersen, R.J., Williams, D., Holmes, C.F., James, M.N.
Deposit date:2005-10-19
Release date:2006-01-17
Last modified:2012-12-12
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Crystal Structures of Protein Phosphatase-1 Bound to Motuporin and Dihydromicrocystin-LA: Elucidation of the Mechanism of Enzyme Inhibition by Cyanobacterial Toxins.
J.Mol.Biol., 356, 2006