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Structure paper

TitleCrystal Cryocooling Distorts Conformational Heterogeneity in a Model Michaelis Complex of DHFR.
Journal, issue, pagesStructure, Vol. 22, Page 899-910, Year 2014
Publish dateMar 10, 2014 (structure data deposition date)
AuthorsKeedy, D.A. / van den Bedem, H. / Sivak, D.A. / Petsko, G.A. / Ringe, D. / Wilson, M.A. / Fraser, J.S.
External linksStructure / PubMed:24882744
MethodsX-ray diffraction
Resolution0.849 - 1.351 Å
Structure data

PDB-4p3q:
Room-temperature WT DHFR, time-averaged ensemble
Method: X-RAY DIFFRACTION / Resolution: 1.351 Å

PDB-4p3r:
Cryogenic WT DHFR, time-averaged ensemble
Method: X-RAY DIFFRACTION / Resolution: 1.15 Å

PDB-4pss:
Multiconformer model for Escherichia coli dihydrofolate reductase at 100K
Method: X-RAY DIFFRACTION / Resolution: 0.849 Å

PDB-4pst:
Multiconformer model for Escherichia coli dihydrofolate reductase at 277 K
Method: X-RAY DIFFRACTION / Resolution: 1.05 Å

PDB-4pth:
Ensemble model for Escherichia coli dihydrofolate reductase at 100K
Method: X-RAY DIFFRACTION / Resolution: 0.85 Å

PDB-4ptj:
Ensemble model for Escherichia coli dihydrofolate reductase at 277K
Method: X-RAY DIFFRACTION / Resolution: 1.05 Å

Chemicals

ChemComp-FOL:
FOLIC ACID

ChemComp-CA:
Unknown entry

ChemComp-NAP:
NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE

ChemComp-HOH:
WATER

ChemComp-MN:
Unknown entry

Source
  • escherichia coli (E. coli)
KeywordsOXIDOREDUCTASE / ROSSMANN FOLD / reductase

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