3BYC

Joint neutron and X-ray structure of diisopropyl fluorophosphatase. Deuterium occupancies are 1-Q, where Q is occupancy of H

Summary for 3BYC

• Entry DOI: 10.2210/pdb3byc/pdb
• Related: 2GVW
• Descriptor: Diisopropyl-fluorophosphatase, CALCIUM ION (3 entities in total)
• Functional Keywords: beta-propeller, phosphotriesterase, hydrolase
• Biological source: Loligo vulgaris (Squid)
• Total number of polymer chains: 1
• Total formula weight: 35200.87

Authors

Blum, M.-M.,Mustyakimov, M.,Ruterjans, H.,Schoenborn, B.P.,Langan, P.,Chen, J.C.-H. (deposition date: 2008-01-15, release date: 2009-01-27, Last modification date: 2024-02-21)

• Primary citation: Blum, M.M.,Mustyakimov, M.,Ruterjans, H.,Kehe, K.,Schoenborn, B.P.,Langan, P.,Chen, J.C.; Rapid determination of hydrogen positions and protonation states of diisopropyl fluorophosphatase by joint neutron and X-ray diffraction refinement.; Proc.Natl.Acad.Sci.Usa, 106:713-718, 2009; PubMed: 19136630; DOI: 10.1073/pnas.0807842106

Experimental method

NEUTRON DIFFRACTION (2.2 Å)
X-RAY DIFFRACTION (2.2 Å)