Author results

1LCF
  • Download 1lcf
  • View 1lcf
Molmil generated image of 1lcf
CRYSTAL STRUCTURE OF COPPER-AND OXALATE-SUBSTITUTED HUMAN LACTOFERRIN AT 2.0 ANGSTROMS RESOLUTION
Descriptor:LACTOFERRIN, N-ACETYL-D-GLUCOSAMINE, COPPER (II) ION, ...
Authors:Smith, C.A., Anderson, B.F., Baker, H.M., Baker, E.N.
Deposit date:1994-01-11
Release date:1994-08-31
Last modified:2017-11-29
Method:X-RAY DIFFRACTION (2 Å)
Cite:Structure of copper- and oxalate-substituted human lactoferrin at 2.0 A resolution.
Acta Crystallogr.,Sect.D, 50, 1994
1MNE
  • Download 1mne
  • View 1mne
Molmil generated image of 1mne
TRUNCATED HEAD OF MYOSIN FROM DICTYOSTELIUM DISCOIDEUM COMPLEXED WITH MG-PYROPHOSPHATE
Descriptor:MYOSIN, MAGNESIUM ION, PYROPHOSPHATE 2-
Authors:Smith, C.A., Rayment, I.
Deposit date:1995-04-20
Release date:1996-08-17
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:X-ray structure of the magnesium(II)-pyrophosphate complex of the truncated head of Dictyostelium discoideum myosin to 2.7 A resolution.
Biochemistry, 34, 1995
1LFI
  • Download 1lfi
  • View 1lfi
Molmil generated image of 1lfi
METAL SUBSTITUTION IN TRANSFERRINS: THE CRYSTAL STRUCTURE OF HUMAN COPPER-LACTOFERRIN AT 2.1 ANGSTROMS RESOLUTION
Descriptor:LACTOFERRIN, N-ACETYL-D-GLUCOSAMINE, BETA-L-FUCOSE, ...
Authors:Smith, C.A., Anderson, B.F., Baker, H.M., Baker, E.N.
Deposit date:1992-02-10
Release date:1993-10-31
Last modified:2017-11-29
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Metal substitution in transferrins: the crystal structure of human copper-lactoferrin at 2.1-A resolution.
Biochemistry, 31, 1992
1DBI
  • Download 1dbi
  • View 1dbi
Molmil generated image of 1dbi
CRYSTAL STRUCTURE OF A THERMOSTABLE SERINE PROTEASE
Descriptor:AK.1 SERINE PROTEASE, CALCIUM ION, SODIUM ION
Authors:Smith, C.A., Toogood, H.S., Baker, H.M., Daniel, R.M., Baker, E.N.
Deposit date:1999-11-02
Release date:1999-11-18
Last modified:2017-10-04
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Calcium-mediated thermostability in the subtilisin superfamily: the crystal structure of Bacillus Ak.1 protease at 1.8 A resolution.
J.Mol.Biol., 294, 1999
2GC5
  • Download 2gc5
  • View 2gc5
Molmil generated image of 2gc5
G51S MUTANT OF L. CASEI FPGS
Descriptor:Folylpolyglutamate synthase, SULFATE ION
Authors:Smith, C.A., Cross, J.A., Bognar, A.L., Sun, X.
Deposit date:2006-03-13
Release date:2006-06-27
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:Mutation of Gly51 to serine in the P-loop of Lactobacillus casei folylpolyglutamate synthetase abolishes activity by altering the conformation of two adjacent loops.
Acta Crystallogr.,Sect.D, 62, 2006
2GC6
  • Download 2gc6
  • View 2gc6
Molmil generated image of 2gc6
S73A MUTANT OF L. CASEI FPGS
Descriptor:Folylpolyglutamate synthase, SULFATE ION
Authors:Smith, C.A., Cross, J.A., Bognar, A.L., Sun, X.
Deposit date:2006-03-13
Release date:2006-06-27
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Mutation of Gly51 to serine in the P-loop of Lactobacillus casei folylpolyglutamate synthetase abolishes activity by altering the conformation of two adjacent loops.
Acta Crystallogr.,Sect.D, 62, 2006
2GCA
  • Download 2gca
  • View 2gca
Molmil generated image of 2gca
APO FORM OF L. CASEI FPGS
Descriptor:Folylpolyglutamate synthase
Authors:Smith, C.A., Cross, J.A., Bognar, A.L., Sun, X.
Deposit date:2006-03-13
Release date:2006-06-27
Last modified:2017-10-18
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Mutation of Gly51 to serine in the P-loop of Lactobacillus casei folylpolyglutamate synthetase abolishes activity by altering the conformation of two adjacent loops.
Acta Crystallogr.,Sect.D, 62, 2006
2GCB
  • Download 2gcb
  • View 2gcb
Molmil generated image of 2gcb
G51S/S52T DOUBLE MUTANT OF L. CASEI FPGS
Descriptor:Folylpolyglutamate synthase
Authors:Smith, C.A., Cross, J.A., Bognar, A.L., Sun, X.
Deposit date:2006-03-13
Release date:2006-06-27
Last modified:2017-10-18
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Mutation of Gly51 to serine in the P-loop of Lactobacillus casei folylpolyglutamate synthetase abolishes activity by altering the conformation of two adjacent loops.
Acta Crystallogr.,Sect.D, 62, 2006
2QPN
  • Download 2qpn
  • View 2qpn
Molmil generated image of 2qpn
GES-1 BETA-LACTAMASE
Descriptor:Beta-lactamase GES-1, SULFATE ION
Authors:Smith, C.A., Caccamo, M., Kantardjieff, K.A., Vakulenko, S.
Deposit date:2007-07-24
Release date:2008-08-12
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.1 Å)
Cite:Structure of GES-1 at atomic resolution: insights into the evolution of carbapenamase activity in the class A extended-spectrum beta-lactamases.
Acta Crystallogr.,Sect.D, 63, 2007
3TDV
  • Download 3tdv
  • View 3tdv
Molmil generated image of 3tdv
STRUCTURE OF THE GDP COMPLEX OF WILD-TYPE AMINOGLYCOSIDE 2'-PHOSPHOTRANSFERASE-IIIA
Descriptor:Gentamicin resistance protein, GUANOSINE-5'-DIPHOSPHATE, MAGNESIUM ION
Authors:Smith, C.A., Vakulenko, S.B.
Deposit date:2011-08-11
Release date:2012-03-07
Last modified:2012-05-02
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Aminoglycoside-2' phosphotransferase-IIIa (APH(2')-IIIa) prefers GTP over ATP: Structural templates for nucleotide recognition in the bacterial aminoglycoside-2' kinases.
J.Biol.Chem., 287, 2012
3TDW
  • Download 3tdw
  • View 3tdw
Molmil generated image of 3tdw
THE GDP COMPLEX OF THE AMINOGLYCOSIDE 2'-PHOSPHOTRANSFERE-IIIA F108L MUTANT
Descriptor:Gentamicin resistance protein, GUANOSINE-5'-DIPHOSPHATE, MAGNESIUM ION
Authors:Smith, C.A., Vakulenko, S.B.
Deposit date:2011-08-11
Release date:2012-03-07
Last modified:2012-05-02
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Aminoglycoside 2''-Phosphotransferase IIIa (APH(2'')-IIIa) Prefers GTP over ATP: STRUCTURAL TEMPLATES FOR NUCLEOTIDE RECOGNITION IN THE BACTERIAL AMINOGLYCOSIDE-2'' KINASES.
J.Biol.Chem., 287, 2012
4GNU
  • Download 4gnu
  • View 4gnu
Molmil generated image of 4gnu
CRYSTAL STRUCTURE OF GES-5 CARBAPENEMASE
Descriptor:Beta-lactamase GES-5, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID
Authors:Smith, C.A., Vakulenko, S.B.
Deposit date:2012-08-17
Release date:2013-07-24
Method:X-RAY DIFFRACTION (1.09 Å)
Cite:Structural basis for progression toward the carbapenemase activity in the GES family of beta-lactamases.
J.Am.Chem.Soc., 134, 2012
4GOG
  • Download 4gog
  • View 4gog
Molmil generated image of 4gog
CRYSTAL STRUCTURE OF THE GES-1 IMIPENEM ACYL-ENZYME COMPLEX
Descriptor:Beta-lactamase GES-1, (5R)-5-[(1S,2R)-1-formyl-2-hydroxypropyl]-3-[(2-{[(E)-iminomethyl]amino}ethyl)sulfanyl]-4,5-dihydro-1H-pyrrole-2-carboxylic acid, IODIDE ION, ...
Authors:Smith, C.A., Vakulenko, S.B., Munoz, J.
Deposit date:2012-08-20
Release date:2013-07-24
Method:X-RAY DIFFRACTION (1.1 Å)
Cite:Structural basis for progression toward the carbapenemase activity in the GES family of beta-lactamases.
J.Am.Chem.Soc., 134, 2012
4H8R
  • Download 4h8r
  • View 4h8r
Molmil generated image of 4h8r
IMIPENEM COMPLEX OF GES-5 CARBAPENEMASE
Descriptor:Extended-spectrum beta-lactamase GES-5, (5R)-5-[(1S,2R)-1-formyl-2-hydroxypropyl]-3-[(2-{[(E)-iminomethyl]amino}ethyl)sulfanyl]-4,5-dihydro-1H-pyrrole-2-carboxylic acid, IODIDE ION, ...
Authors:Smith, C.A., Vakulenko, S.B.
Deposit date:2012-09-23
Release date:2013-07-24
Method:X-RAY DIFFRACTION (1.25 Å)
Cite:Structural basis for progression toward the carbapenemase activity in the GES family of beta-lactamases.
J.Am.Chem.Soc., 134, 2012
4JF4
  • Download 4jf4
  • View 4jf4
Molmil generated image of 4jf4
OXA-23 MEROPENEM COMPLEX
Descriptor:Beta-lactamase, 1,2-ETHANEDIOL, (4R,5S)-3-{[(3S,5S)-5-(dimethylcarbamoyl)pyrrolidin-3-yl]sulfanyl}-5-[(2S,3R)-3-hydroxy-1-oxobutan-2-yl]-4-methyl-4,5-dihydro-1H-pyrrole-2-carboxylic acid
Authors:Smith, C.A., Vakulenko, S.B., Toth, M.
Deposit date:2013-02-27
Release date:2013-09-25
Last modified:2013-10-09
Method:X-RAY DIFFRACTION (2.14 Å)
Cite:Structural Basis for Carbapenemase Activity of the OXA-23 beta-Lactamase from Acinetobacter baumannii.
Chem.Biol., 20, 2013
4JF5
  • Download 4jf5
  • View 4jf5
Molmil generated image of 4jf5
STRUCTURE OF OXA-23 AT PH 4.1
Descriptor:Beta-lactamase, CITRATE ANION, 1,2-ETHANEDIOL
Authors:Smith, C.A., Vakulenko, S.B.
Deposit date:2013-02-27
Release date:2013-09-25
Last modified:2013-10-09
Method:X-RAY DIFFRACTION (1.15 Å)
Cite:Structural Basis for Carbapenemase Activity of the OXA-23 beta-Lactamase from Acinetobacter baumannii.
Chem.Biol., 20, 2013
4JF6
  • Download 4jf6
  • View 4jf6
Molmil generated image of 4jf6
STRUCTURE OF OXA-23 AT PH 7.0
Descriptor:Beta-lactamase, POTASSIUM ION, CHLORIDE ION, ...
Authors:Smith, C.A., Vakulenko, S.B.
Deposit date:2013-02-27
Release date:2013-09-25
Last modified:2013-10-09
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structural Basis for Carbapenemase Activity of the OXA-23 beta-Lactamase from Acinetobacter baumannii.
Chem.Biol., 20, 2013
4OH0
  • Download 4oh0
  • View 4oh0
Molmil generated image of 4oh0
CRYSTAL STRUCTURE OF OXA-58 CARBAPENEMASE
Descriptor:Beta-lactamase OXA-58, CHLORIDE ION
Authors:Smith, C.A., Antunes, N.T., Toth, M., Vakulenko, S.B.
Deposit date:2014-01-16
Release date:2014-02-26
Last modified:2014-04-02
Method:X-RAY DIFFRACTION (1.3 Å)
Cite:Crystal Structure of Carbapenemase OXA-58 from Acinetobacter baumannii.
Antimicrob.Agents Chemother., 58, 2014
4ORK
  • Download 4ork
  • View 4ork
Molmil generated image of 4ork
CRYSTAL STRUCTURE OF THE PHOSPHOTRANSFERASE DOMAIN OF THE BIFUNCTIONAL AMINOGLYCOSIDE RESISTANCE ENZYME AAC(6')-IE-APH(2'')-IA
Descriptor:Bifunctional AAC/APH, GUANOSINE-5'-DIPHOSPHATE, MAGNESIUM ION
Authors:Smith, C.A., Toth, M., Bhattacharya, M., Frase, H., Vakulenko, S.B.
Deposit date:2014-02-11
Release date:2014-07-02
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Structure of the phosphotransferase domain of the bifunctional aminoglycoside-resistance enzyme AAC(6')-Ie-APH(2'')-Ia.
Acta Crystallogr.,Sect.D, 70, 2014
4QC6
  • Download 4qc6
  • View 4qc6
Molmil generated image of 4qc6
CRYSTAL STRUCTURE OF AMINOGLYCOSIDE 6'-ACETYLTRANSFERASE-IE
Descriptor:Bifunctional AAC/APH, KANAMYCIN A, (3R,5S,9R)-1-[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]-3,5,9-trihydroxy-8,8-dimethyl-10,14-dioxo-2,4,6-trioxa-11,15-diaza-3,5-diphosphaheptadecane-17-sulfinic acid 3,5-dioxide (non-preferred name), ...
Authors:Smith, C.A., Toth, M., Weiss, T.M., Frase, H., Vakulenko, S.B.
Deposit date:2014-05-09
Release date:2014-10-22
Method:X-RAY DIFFRACTION (1.3 Å)
Cite:Structure of the bifunctional aminoglycoside-resistance enzyme AAC(6')-Ie-APH(2'')-Ia revealed by crystallographic and small-angle X-ray scattering analysis.
Acta Crystallogr.,Sect.D, 70, 2014
4ZDX
  • Download 4zdx
  • View 4zdx
Molmil generated image of 4zdx
STRUCTURE OF OXA-51 BETA-LACTAMASE
Descriptor:Beta-lactamase, 2-[2-(2-METHOXY-ETHOXY)-ETHOXY]-ETHOXYL, GLYCEROL
Authors:Smith, C.A., Antunes, N.T., Stewart, N.K., Frase, H., Toth, M., Kantardjieff, K.A., Vakulenko, S.B.
Deposit date:2015-04-20
Release date:2015-06-17
Last modified:2015-09-02
Method:X-RAY DIFFRACTION (2.001 Å)
Cite:Structural Basis for Enhancement of Carbapenemase Activity in the OXA-51 Family of Class D beta-Lactamases.
Acs Chem.Biol., 10, 2015
5F82
  • Download 5f82
  • View 5f82
Molmil generated image of 5f82
APO GES-5 C69G MUTANT
Descriptor:Beta-lactamase, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID
Authors:Smith, C.A., Vakulenko, S.B.
Deposit date:2015-12-08
Release date:2016-09-07
Last modified:2016-10-26
Method:X-RAY DIFFRACTION (0.96 Å)
Cite:Role of the Conserved Disulfide Bridge in Class A Carbapenemases.
J.Biol.Chem., 291, 2016
5F83
  • Download 5f83
  • View 5f83
Molmil generated image of 5f83
IMIPENEM COMPLEX OF THE GES-5 C69G MUTANT
Descriptor:Beta-lactamase, (5R)-5-[(1S,2R)-1-formyl-2-hydroxypropyl]-3-[(2-{[(E)-iminomethyl]amino}ethyl)sulfanyl]-4,5-dihydro-1H-pyrrole-2-carboxylic acid
Authors:Smith, C.A., Vakulenko, S.B.
Deposit date:2015-12-09
Release date:2016-09-07
Last modified:2017-11-22
Method:X-RAY DIFFRACTION (1.38 Å)
Cite:Role of the Conserved Disulfide Bridge in Class A Carbapenemases.
J.Biol.Chem., 291, 2016
6BFF
  • Download 6bff
  • View 6bff
Molmil generated image of 6bff
STRUCTURE OF THE AMINOGLYCOSIDE ACETYLTRANSFERASE AAC(6')-IM
Descriptor:Aminoglycoside acetyltransferase, MAGNESIUM ION
Authors:Smith, C.A., Vakulenko, S.B.
Deposit date:2017-10-26
Release date:2017-11-08
Last modified:2017-12-27
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Aminoglycoside resistance profile and structural architecture of the aminoglycoside acetyltransferase AAC(6')-Im.
Microb Cell, 4, 2017
6BFH
  • Download 6bfh
  • View 6bfh
Molmil generated image of 6bfh
STRUCTURE OF THE KANAMYCIN COMPLEX OF AMINOGLYCOSIDE ACETYLTRANSFERASE AAC(6')-IM
Descriptor:Aminoglycoside acetyltransferase, KANAMYCIN A, GLYCEROL
Authors:Smith, C.A., Vakulenko, S.B.
Deposit date:2017-10-26
Release date:2017-11-08
Last modified:2017-12-27
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Aminoglycoside resistance profile and structural architecture of the aminoglycoside acetyltransferase AAC(6')-Im.
Microb Cell, 4, 2017