Mass: 63091.121 Da / Num. of mol.: 2 Source method: isolated from a genetically manipulated source Details: Residues that are not present in the coordinate file are disordered and not visible in the electron density. Side chain atoms of residues His149A, Ser328A, His149B, Met52B, His149B, Ser328B ...Details: Residues that are not present in the coordinate file are disordered and not visible in the electron density. Side chain atoms of residues His149A, Ser328A, His149B, Met52B, His149B, Ser328B which lie on the protein surface" have been included in the pdb but set at zero occupancy because they completely lack electron density. Source: (gene. exp.) Penicillium simplicissimum (fungus) / Gene: VAOA / Production host: Escherichia coli (E. coli) / References: UniProt: P56216, vanillyl-alcohol oxidase
Resolution: 2.8→54.91 Å / Cor.coef. Fo:Fc: 0.951 / Cor.coef. Fo:Fc free: 0.89 / SU B: 19.3 / SU ML: 0.353 / Cross valid method: THROUGHOUT / ESU R Free: 0.454 / Stereochemistry target values: MAXIMUM LIKELIHOOD / Details: HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS
Rfactor
Num. reflection
% reflection
Selection details
Rfree
0.2586
1309
4.8 %
RANDOM
Rwork
0.17997
-
-
-
obs
0.18383
25824
88.56 %
-
Solvent computation
Ion probe radii: 0.8 Å / Shrinkage radii: 0.8 Å / VDW probe radii: 1.2 Å / Solvent model: MASK