Crystal structure of the enterobactin esterase FES from Shigella flexneri in the presence of 2,3-Di-hydroxy-N-benzoyl-glycine

Midwest Center for Structural Genomics (MCSG)

Siderophore Mediated Iron Acquisition: Structure and Specificity of Enterobactin Esterase from Shigella flexneri.

20% PEG 3000, 0.1 M Citrate pH 5.5, 3 mM DHBG, 1 mM FeCl3, VAPOR DIFFUSION, SITTING DROP, temperature 291K

Crystal structure of enterochelin esterase IroD from Shigella flexneri

Crystal structure of enterobactin esterase FES from Shigella flexneri in the presence of enterobactin

Crystal structure of enterobactin esterase FES from Shigella flexneri in the presence of 2,3-Di-hydroxy-N-benzoyl-serine

Crystal structure of BES protein from Bacillus cereus

Crystal structure of enterobactin and salmochelin hydrolase IroE

Crystal structure of enterobactin hydrolase IroE complex with DFP

1. TWINNING: TWIN LAW: h,-k,-l, TWIN FRACTION: 0.354. 2. When refining TLS, the output PDB file always has the ANISOU records for the atoms involved in TLS groups. The anisotropic B-factor in ANISOU records is the total B-factor (B_tls + B_individual). The isotropic equivalent B-factor in ATOM records is the mean of the trace of the ANISOU matrix divided by 10000 and multiplied by 8*pi^2 and represents the isotropic equivalent of the total B-factor (B_tls + B_individual). To obtain the individual B-factors, one needs to compute the TLS component (B_tls) using the TLS records in the PDB file header and then subtract it from the total B-factors (on the ANISOU records).

alpha-beta-alpha sandwich, IroD, Iron aquisition, Structural Genomics, PSI-2, Protein Structure Initiative, Midwest Center for Structural Genomics, MCSG, HYDROLASE