wwPDB validation report of PDB entry 3NI5

4-(nitrooxy)butyl 3-[(5-sulfamoyl-1,3,4-thiadiazol-2-yl)sulfamoyl]benzoate

Carbonic anhydrase II, CA-II, Carbonate dehydratase II, Carbonic anhydrase C, CAC

carbonic anhydrase II in complex with Nir inhibitor

THE GAP IS IN THE SEQUENCE NUMBERING AS THE STARTING MODEL 1CA2.

HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS

The largest off-origin peak in the Patterson function is 7.85% of the height of the origin peak. No significant pseudotranslation is detected.

20191225.v01 (using entries in the PDB archive December 25th 2019)

structure factor analysis and validation

geometric validation package for ligand chemistry in protein x-ray structures