Author results

4KH3
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STRUCTURE OF A BACTERIAL SELF-ASSOCIATING PROTEIN
Descriptor:Antigen 43, MALONATE ION
Authors:Heras, B., Gee, C.L., Schembri, M.A., Totsika, M.
Deposit date:2013-04-30
Release date:2014-01-15
Last modified:2015-06-17
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:The antigen 43 structure reveals a molecular Velcro-like mechanism of autotransporter-mediated bacterial clumping.
Proc.Natl.Acad.Sci.USA, 111, 2014
4C7M
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THE CRYSTAL STRUCTURE OF TCPB OR BTPA TIR DOMAIN
Descriptor:TIR DOMAIN-CONTAINING PROTEIN
Authors:Alaidarous, M., Ve, T., Casey, L.W., Valkov, E., Ullah, M.O., Schembri, M.A., Mansell, A., Sweet, M.J., Kobe, B.
Deposit date:2013-09-23
Release date:2013-12-04
Last modified:2014-01-29
Method:X-RAY DIFFRACTION (2.57 Å)
Cite:Mechanism of Bacterial Interference with Tlr4 Signaling by Brucella Tir-Domain-Containing Protein Tcpb
J.Biol.Chem., 289, 2014
4GXZ
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CRYSTAL STRUCTURE OF A PERIPLASMIC THIOREDOXIN-LIKE PROTEIN FROM SALMONELLA ENTERICA SEROVAR TYPHIMURIUM
Descriptor:Suppression of copper sensitivity protein
Authors:Shepherd, M., Heras, B., King, G.J., Argente, M.P., Achard, M.E.S., King, N.P., McEwan, A.G., Schembri, M.A.
Deposit date:2012-09-04
Release date:2013-07-17
Last modified:2014-03-12
Method:X-RAY DIFFRACTION (2.04 Å)
Cite:Structural and functional characterization of ScsC, a periplasmic thioredoxin-like protein from Salmonella enterica serovar Typhimurium
Antioxid Redox Signal, 19, 2013
5EK5
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STRUCTURAL CHARACTERIZATION OF IRMA FROM ESCHERICHIA COLI
Descriptor:IRMA, CHLORIDE ION, FORMIC ACID, ...
Authors:Heras, B., Moriel, D.G., Paxman, J.J., Schembri, M.A.
Deposit date:2015-11-03
Release date:2016-03-09
Last modified:2016-07-13
Method:X-RAY DIFFRACTION (2.26 Å)
Cite:Molecular and Structural Characterization of a Novel Escherichia coli Interleukin Receptor Mimic Protein.
Mbio, 7, 2016
6AQJ
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CRYSTAL STRUCTURES OF STAPHYLOCOCCUS AUREUS KETOL-ACID REDUCTOISOMERASE IN COMPLEX WITH TWO TRANSITION STATE ANALOGS THAT HAVE BIOCIDAL ACTIVITY.
Descriptor:Ketol-acid reductoisomerase (NADP(+)), MAGNESIUM ION, oxo(propan-2-ylamino)acetic acid, ...
Authors:Patel, K.M., Teran, D., Zheng, S., Gracia, M., Lv, Y., Schembri, M.A., McGeary, R.P., Schenk, G., Guddat, L.W.
Deposit date:2017-08-20
Release date:2017-10-18
Last modified:2018-01-03
Method:X-RAY DIFFRACTION (1.373 Å)
Cite:Crystal Structures of Staphylococcus aureus Ketol-Acid Reductoisomerase in Complex with Two Transition State Analogues that Have Biocidal Activity.
Chemistry, 23, 2017
6BUL
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CRYSTAL STRUCTURE OF STAPHYLOCOCCUS AUREUS KETOL-ACID REDUCTOISOMERASE WITH HYDROXYOXAMATE INHIBITOR 2
Descriptor:Ketol-acid reductoisomerase (NADP(+)), MAGNESIUM ION, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
Authors:Kandale, A., Patel, K.M., Zheng, S., You, L., Guddat, L.W., Schenk, G., Schembri, M.A., McFeary, R.P.
Deposit date:2017-12-10
Release date:2018-12-12
Method:X-RAY DIFFRACTION (1.88 Å)
Cite:Design, synthesis, in vitro activity and crystallisation of novel N-isopropyl-N-hydroxyoxamate derivatives as ketol-acid reductoisomerase (KARI) inhibitors
To Be Published
6C5N
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CRYSTAL STRUCTURE OF STAPHYLOCOCCUS AUREUS KETOL-ACID REDUCTOISOMERASE WITH HYDROXYOXAMATE INHIBITOR 1
Descriptor:Ketol-acid reductoisomerase (NADP(+)), NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, MAGNESIUM ION, ...
Authors:Kandale, A., Patel, K.M., Zheng, S., You, L., Guddat, L.W., Schenk, G., Schembri, M.A., McGeary, R.P.
Deposit date:2018-01-16
Release date:2019-01-30
Method:X-RAY DIFFRACTION (1.673 Å)
Cite:Design, synthesis, in vitro activity and crystallisation of novel N-isopropyl-N-hydroxyoxamate derivatives as ketol-acid reductosiomerase (KARI) inhibitor
To Be Published
5W3K
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CRYSTAL STRUCTURE OF STAPHYLOCOCCUS AUREUS KETOL-ACID REDUCTOISOMERASE IN COMPLEX NADPH, MG2+ AND CPD
Descriptor:Ketol-acid reductoisomerase (NADP(+)), cyclopropane-1,1-dicarboxylic acid, MAGNESIUM ION, ...
Authors:Patel, K.M., Teran, D., Zheng, S., Kandale, A., Schembri, M., McGeary, R.P., Schenk, G., Guddat, L.W.
Deposit date:2017-06-08
Release date:2017-10-25
Last modified:2018-01-17
Method:X-RAY DIFFRACTION (1.589 Å)
Cite:Crystal Structures of Staphylococcus aureus Ketol-Acid Reductoisomerase in Complex with Two Transition State Analogues that Have Biocidal Activity.
Chemistry, 23, 2017
5ID4
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CRYSTAL STRUCTURE OF PROTEUS MIRABILIS SCSC IN AN EXTENDED CONFORMATION
Descriptor:DsbA-like protein
Authors:Furlong, E.J., Kurth, F., Choudhury, H.G., Martin, J.L.
Deposit date:2016-02-23
Release date:2017-07-26
Last modified:2018-01-17
Method:X-RAY DIFFRACTION (2.921 Å)
Cite:Proteus mirabilis ScsC is a highly dynamic, novel trimeric protein disulfide isomerase
Nat Commun, 2017
5IDR
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CRYSTAL STRUCTURE OF PROTEUS MIRABILIS SCSC IN A TRANSITIONAL CONFORMATION
Descriptor:DsbA-like protein
Authors:Furlong, E.J., Kurth, F., Choudhury, H.G., Martin, J.L.
Deposit date:2016-02-24
Release date:2017-08-02
Last modified:2018-01-17
Method:X-RAY DIFFRACTION (2.562 Å)
Cite:A shape-shifting redox foldase contributes to Proteus mirabilis copper resistance.
Nat Commun, 8, 2017
3L9S
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CRYSTAL STRUCTURE OF SALMONELLA ENTERICA SEROVAR TYPHIMURIUM DSBA
Descriptor:Thiol:disulfide interchange protein
Authors:Heras, B., Jarrott, R., Shouldice, S.R., Guncar, G.
Deposit date:2010-01-05
Release date:2010-03-09
Last modified:2017-11-01
Method:X-RAY DIFFRACTION (1.58 Å)
Cite:Structural and functional characterization of three DsbA paralogues from Salmonella enterica serovar typhimurium
J.Biol.Chem., 285, 2010
3L9U
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CRYSTAL STRUCTURE OF SALMONELLA ENTERICA SEROVAR TYPHIMURIUM DSBL
Descriptor:Disulfide isomerase
Authors:Heras, B., Jarrott, R., Shouldice, S.R., Guncar, G.
Deposit date:2010-01-05
Release date:2010-03-09
Last modified:2017-11-01
Method:X-RAY DIFFRACTION (1.568 Å)
Cite:Structural and functional characterization of three DsbA paralogues from Salmonella enterica serovar typhimurium
J.Biol.Chem., 285, 2010
3L9V
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CRYSTAL STRUCTURE OF SALMONELLA ENTERICA SEROVAR TYPHIMURIUM SRGA
Descriptor:Putative thiol-disulfide isomerase or thioredoxin, 3,6,9,12,15,18,21-HEPTAOXATRICOSANE-1,23-DIOL, O-ACETALDEHYDYL-HEXAETHYLENE GLYCOL, ...
Authors:Heras, B., Jarrott, R., Shouldice, S.R., Guncar, G.
Deposit date:2010-01-05
Release date:2010-03-09
Last modified:2017-11-01
Method:X-RAY DIFFRACTION (2.151 Å)
Cite:Structural and functional characterization of three DsbA paralogues from Salmonella enterica serovar typhimurium
J.Biol.Chem., 285, 2010
4ML1
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DISULFIDE ISOMERASE (DSBP) FROM MULTIDRUG RESISTANCE INCA/C TRANSFERABLE PLASMID IN OXIDIZED STATE (P212121 SPACE GROUP)
Descriptor:DsbP
Authors:Premkumar, L., Kurth, F., Neyer, S., Martin, J.L.
Deposit date:2013-09-06
Release date:2013-12-11
Last modified:2017-11-15
Method:X-RAY DIFFRACTION (1.978 Å)
Cite:The Multidrug Resistance IncA/C Transferable Plasmid Encodes a Novel Domain-swapped Dimeric Protein-disulfide Isomerase.
J.Biol.Chem., 289, 2014
4ML6
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DISULFIDE ISOMERASE FROM MULTIDRUG RESISTANCE INCA/C CONJUGATIVE PLASMID IN REDUCED STATE
Descriptor:DsbP
Authors:Premkumar, L., Kurth, F., Neyer, S., Martin, J.L.
Deposit date:2013-09-06
Release date:2013-12-11
Last modified:2017-11-15
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:The Multidrug Resistance IncA/C Transferable Plasmid Encodes a Novel Domain-swapped Dimeric Protein-disulfide Isomerase.
J.Biol.Chem., 289, 2014
4MLY
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DISULFIDE ISOMERASE FROM MULTIDRUG RESISTANCE INCA/C RELATED INTEGRATIVE AND CONJUGATIVE ELEMENTS IN OXIDIZED STATE (P21 SPACE GROUP)
Descriptor:DsbP, 1,3-BUTANEDIOL
Authors:Premkumar, L., Kurth, F., Neyer, S., Martin, J.L.
Deposit date:2013-09-06
Release date:2013-12-11
Last modified:2017-11-15
Method:X-RAY DIFFRACTION (2.207 Å)
Cite:The Multidrug Resistance IncA/C Transferable Plasmid Encodes a Novel Domain-swapped Dimeric Protein-disulfide Isomerase.
J.Biol.Chem., 289, 2014
4OCE
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CRYSTAL STRUCTURE OF THE DISULFIDE OXIDOREDUCTASE DSBA FROM PROTEUS MIRABILIS
Descriptor:Thiol:disulfide interchange protein, MALONATE ION
Authors:Kurth, F., Martin, J.L.
Deposit date:2014-01-09
Release date:2014-05-28
Last modified:2017-11-22
Method:X-RAY DIFFRACTION (1.768 Å)
Cite:Crystal Structure of the Dithiol Oxidase DsbA Enzyme from Proteus Mirabilis Bound Non-covalently to an Active Site Peptide Ligand.
J.Biol.Chem., 289, 2014
4OCF
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CRYSTAL STRUCTURE OF THE DISULFIDE OXIDOREDUCTASE DSBA (S30XXC33) ACTIVE SITE MUTANT FROM PROTEUS MIRABILIS
Descriptor:Thiol:disulfide interchange protein, THIOCYANATE ION
Authors:Kurth, F., Martin, J.L.
Deposit date:2014-01-09
Release date:2014-05-28
Last modified:2017-11-22
Method:X-RAY DIFFRACTION (1.979 Å)
Cite:Crystal Structure of the Dithiol Oxidase DsbA Enzyme from Proteus Mirabilis Bound Non-covalently to an Active Site Peptide Ligand.
J.Biol.Chem., 289, 2014
4OD7
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COMPLEX STRUCTURE OF PROTEUS MIRABLIS DSBA (C30S) WITH A NON-COVALENTLY BOUND PEPTIDE PWATCDS
Descriptor:Thiol:disulfide interchange protein, (ACE)PWATCDS(NH2) Peptide, THIOCYANATE ION
Authors:Kurth, F., Premkumar, L., Martin, J.L.
Deposit date:2014-01-10
Release date:2014-05-28
Last modified:2017-11-22
Method:X-RAY DIFFRACTION (1.597 Å)
Cite:Crystal Structure of the Dithiol Oxidase DsbA Enzyme from Proteus Mirabilis Bound Non-covalently to an Active Site Peptide Ligand.
J.Biol.Chem., 289, 2014
4YPO
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CRYSTAL STRUCTURE OF MYCOBACTERIUM TUBERCULOSIS KETOL-ACID REDUCTOISOMERASE IN COMPLEX WITH MG2+
Descriptor:Ketol-acid reductoisomerase, MAGNESIUM ION, CHLORIDE ION, ...
Authors:Lv, Y., Guddat, L.W.
Deposit date:2015-03-13
Release date:2016-02-17
Last modified:2016-04-27
Method:X-RAY DIFFRACTION (1.001 Å)
Cite:Crystal structure of Mycobacterium tuberculosis ketol-acid reductoisomerase at 1.0 angstrom resolution - a potential target for anti-tuberculosis drug discovery.
Febs J., 283, 2016
4Z9C
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ECPLTAB OXIDIZED
Descriptor:Pertussis toxin-like subunit ArtA, Subtilase cytotoxin subunit B-like protein, PHOSPHATE ION
Authors:Littler, D.R., Johnson, M.D., Summers, R.J., Schembri, M.A., Rossjohn, J., Beddoe, T.
Deposit date:2015-04-10
Release date:2016-10-12
Last modified:2017-08-09
Method:X-RAY DIFFRACTION (2.35 Å)
Cite:Structure and function analyses of a pertussis-like toxin from pathogenic Escherichia coli reveal a distinct mechanism of inhibition of trimeric G proteins.
J. Biol. Chem., 2017
4Z9D
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ECPLTA
Descriptor:Pertussis toxin-like subunit ArtA, SODIUM ION, NICOTINAMIDE-ADENINE-DINUCLEOTIDE
Authors:Littler, D.R., Johnson, M.D., Summers, R.J., Schembri, M.A., Rossjohn, J., Beddoe, T.
Deposit date:2015-04-10
Release date:2016-10-12
Last modified:2017-08-09
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Structure and function analyses of a pertussis-like toxin from pathogenic Escherichia coli reveal a distinct mechanism of inhibition of trimeric G proteins.
J. Biol. Chem., 2017
6BEA
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CRYSTAL STRUCTURE OF THE AUTOTRANSPORTER UPAB FROM E. COLI STRAIN CFT073
Descriptor:Autotransporter protein UpaB, GLYCEROL, HEXAETHYLENE GLYCOL, ...
Authors:Paxman, J.J., Heras, B.
Deposit date:2017-10-25
Release date:2019-04-10
Last modified:2019-05-15
Method:X-RAY DIFFRACTION (1.97 Å)
Cite:Unique structural features of a bacterial autotransporter adhesin suggest mechanisms for interaction with host macromolecules.
Nat Commun, 10, 2019