wwPDB validation report of PDB entry 1N4U

FAD COFACTOR NON-COVALENTLY BOUND TO THE ENZYME

FLAVIN-N7 PROTONATED-ADENINE DINUCLEOTIDE

THE FOLLOWING ARE RESIDUES THAT WERE NOT LOCATED IN THE EXPERIMENT: ASP A 6, ASN A 7, GLY A 8, THR A 507 (ONLY N WAS LOCATED), ALA A 508, SER A 509. SOME VERY MOBILE SIDE CHAINS WERE MODELED AT EITHER 50% OR WERE NOT MODELLED. THE FOLLOWING ATOMS WERE NOT MODELLED: RES 278 CG -> END IS MISSING.; RES 396 CZ->END IS MISSING.; RES 436 CG->END IS MISSING; PARTIALLY OCCUPIED SIDE CHAIN ATOMS MODELED AT 50% FOR THE FOLLOWING: RES 73 ATOMS CG 1HG1 2HG CD OE1 OE2; RESI 127 ATOMS CG 1HD 2HD NE 1HE 2HE NZ 1HZ 2HZ 3HZ;

RES RES 163 ATOMS CE 1HE 2HE NZ 1HZ 2HZ 3HZ;

RES 172 CE 1HE 2HE NZ 1HZ 2HZ 3HZ;

RES 183 CG 1HG 2HG CD 1HD 2HD CE 1HE 2HE NZ 1HZ 2HZ 3HZ;

RES 241 CE 1HE 2HE NZ 1HZ 2HZ 3HZ;

RES 396 CG 1HG 2HG CD 1HD 2HD NE 1HE 2HE ;

RES 398 CE 1HE 2HE NZ 1HZ 2HZ 3HZ;

RES 435 ATOMS CB HB OG1 CG2 1HG2 2HG2 3HG2;

RES 436 ATOMS CB 1HB 2HB; RES 468 ATOMS CG 1HG 2HG CD 1HD 2HD CE 1HE 2HE NZ 1HZ 2HZ 3HZ;

CHOLESTEROL OXIDASE FROM STREPTOMYCES @ pH 4.5 (STREPTOMYCES SP. SA-COO)

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

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