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2INQ
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NEUTRON CRYSTAL STRUCTURE OF ESCHERICHIA COLI DIHYDROFOLATE REDUCTASE BOUND TO THE ANTI-CANCER DRUG, METHOTREXATE
Descriptor:Dihydrofolate reductase, N-(4-{[(2,4-DIAMINOPTERIDIN-1-IUM-6-YL)METHYL](METHYL)AMINO}BENZOYL)-L-GLUTAMIC ACID
Authors:Bennett, B.C., Langan, P.A., Coates, L., Schoenborn, B., Dealwis, C.G.
Deposit date:2006-10-08
Release date:2007-02-06
Last modified:2011-07-13
Method:NEUTRON DIFFRACTION (2.2 Å)
Cite:Neutron diffraction studies of Escherichia coli dihydrofolate reductase complexed with methotrexate.
Proc.Natl.Acad.Sci.Usa, 103, 2006
2QK8
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CRYSTAL STRUCTURE OF THE ANTHRAX DRUG TARGET, BACILLUS ANTHRACIS DIHYDROFOLATE REDUCTASE
Descriptor:Dihydrofolate reductase, METHOTREXATE
Authors:Bennett, B.C., Xu, H., Simmerman, R.F., Lee, R.E., Dealwis, C.G.
Deposit date:2007-07-10
Release date:2007-08-28
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Crystal structure of the anthrax drug target, Bacillus anthracis dihydrofolate reductase.
J.Med.Chem., 50, 2007
3DAT
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CRYSTAL STRUCTURE OF THE TERNARY MTX NADPH COMPLEX OF BACILLUS ANTHRACIS DIHYDROFOLATE REDUCTASE
Descriptor:Dihydrofolate reductase, METHOTREXATE, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
Authors:Bennett, B.C., Dealwis, C.G.
Deposit date:2008-05-30
Release date:2009-04-14
Last modified:2017-10-25
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:X-ray structure of the ternary MTX.NADPH complex of the anthrax dihydrofolate reductase: a pharmacophore for dual-site inhibitor design.
J.Struct.Biol., 166, 2009
3DAU
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CRYSTAL STRUCTURE OF THE TERNARY MTX NADPH COMPLEX OF ESCHERICHIA COLI DIHYDROFOLATE REDUCTASE
Descriptor:Dihydrofolate reductase, METHOTREXATE, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
Authors:Bennett, B.C., Dealwis, C.G.
Deposit date:2008-05-30
Release date:2009-04-14
Last modified:2017-10-25
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:X-ray structure of the ternary MTX.NADPH complex of the anthrax dihydrofolate reductase: a pharmacophore for dual-site inhibitor design.
J.Struct.Biol., 166, 2009
5ER7
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CONNEXIN-26 BOUND TO CALCIUM
Descriptor:Gap junction beta-2 protein, CALCIUM ION
Authors:Purdy, M.D., Bennett, B.C., Baker, K.A., Yeager, M.J.
Deposit date:2015-11-13
Release date:2016-01-27
Method:X-RAY DIFFRACTION (3.286 Å)
Cite:An electrostatic mechanism for Ca(2+)-mediated regulation of gap junction channels.
Nat Commun, 7, 2016
5ERA
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HUMAN CONNEXIN-26 (CALCIUM-FREE)
Descriptor:Gap junction beta-2 protein
Authors:Purdy, M.D., Bennett, B.C., Baker, K.A., Yeager, M.J.
Deposit date:2015-11-13
Release date:2016-01-27
Method:X-RAY DIFFRACTION (3.8 Å)
Cite:An electrostatic mechanism for Ca(2+)-mediated regulation of gap junction channels.
Nat Commun, 7, 2016
4RGC
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277K CRYSTAL STRUCTURE OF ESCHERICHIA COLI DIHYDROFOLATE REDUCTASE
Descriptor:Dihydrofolate reductase, FOLIC ACID, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
Authors:Wilson, M.A., Wan, Q., Bennett, B.C., Dealwis, C.
Deposit date:2014-09-29
Release date:2014-10-15
Last modified:2015-02-25
Method:X-RAY DIFFRACTION (1.05 Å)
Cite:Toward resolving the catalytic mechanism of dihydrofolate reductase using neutron and ultrahigh-resolution X-ray crystallography.
Proc.Natl.Acad.Sci.USA, 111, 2014
4PDJ
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NEUTRON CRYSTAL STRUCTURE OF E.COLI DIHYDROFOLATE REDUCTASE COMPLEXED WITH FOLATE AND NADP+
Descriptor:Dihydrofolate reductase, MANGANESE (II) ION, DIHYDROFOLIC ACID, ...
Authors:Wan, Q., Kovalevsky, A.Y., Wilson, M., Langan, P., Dealwis, C., Bennett, B.
Deposit date:2014-04-18
Release date:2015-04-15
Last modified:2017-09-20
Method:X-RAY DIFFRACTION (1.599 Å), NEUTRON DIFFRACTION
Cite:Toward resolving the catalytic mechanism of dihydrofolate reductase using neutron and ultrahigh-resolution X-ray crystallography.
Proc.Natl.Acad.Sci.USA, 111, 2014
4PSY
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100K CRYSTAL STRUCTURE OF ESCHERICHIA COLI DIHYDROFOLATE REDUCTASE
Descriptor:Dihydrofolate reductase, FOLIC ACID, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
Authors:Wilson, M.A., Wan, Q., Bennet, B.C., Dealwis, C., Ringe, D., Petsko, G.A.
Deposit date:2014-03-08
Release date:2014-05-14
Last modified:2014-12-17
Method:X-RAY DIFFRACTION (0.85 Å)
Cite:Toward resolving the catalytic mechanism of dihydrofolate reductase using neutron and ultrahigh-resolution X-ray crystallography.
Proc.Natl.Acad.Sci.USA, 22, 2014
4HWL
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CRYSTAL STRUCTURE ANALYSIS OF THE BACTERIORHODOPSIN IN FACIAL AMPHIPHILE-7 DMPC BICELLE
Descriptor:Bacteriorhodopsin, RETINAL, HEXANE, ...
Authors:Lee, S., Stout, C.D., Zhang, Q.
Deposit date:2012-11-08
Release date:2013-03-20
Last modified:2013-05-22
Method:X-RAY DIFFRACTION (2 Å)
Cite:Steroid-based facial amphiphiles for stabilization and crystallization of membrane proteins.
Proc.Natl.Acad.Sci.USA, 110, 2013
4HYX
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CRYSTAL STRUCTURE ANALYSIS OF THE BACTERIORHODOPSIN IN FACIAL AMPHIPHILE-4 DMPC BICELLE
Descriptor:Bacteriorhodopsin, RETINAL, N-OCTANE, ...
Authors:Lee, S., Stout, C.D., Zhang, Q.
Deposit date:2012-11-14
Release date:2013-03-20
Last modified:2013-05-22
Method:X-RAY DIFFRACTION (1.99 Å)
Cite:Steroid-based facial amphiphiles for stabilization and crystallization of membrane proteins.
Proc.Natl.Acad.Sci.USA, 110, 2013