PRD_000724

PYOVERDIN 18-1 Fe Complex

PRD_000724 is described in the Biologically Interesting Molecule Reference Dictionary (BIRD).

The representative PDB ID is 2W77.

Find entries where PRD_000724 is present

Toggle Hydrogen Toggle Labels

Chemical Component Summary
Name	PYOVERDIN 18-1 Fe Complex
Identifiers	n/a
Formula	C₅₇ H₈₄ Fe N₁₇ O₂₄
Molecular Weight	1,447.221
Type	PEPTIDE-LIKE
Isomeric SMILES	c1c2cc3c4cc2[n+]5c(c1NC(=O)CCC(=O)O)NCC[C@H]5C(=O)N[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H]6CCCN7C=O[Fe+3]8(O3)(O4)(O7)O=CN(O8)CCC[C@@H]9C(=O)N[C@H](C(=O)[NH2+]CCCC[C@@H](C(=O)N9)NC(=O)CNC(=O)[C@H](NC(=O)[C@@H](NC6=O)CO)CO)CO)CCCC[NH3+])CO
InChI	InChI=1S/C57H83N17O24.Fe/c58-14-3-1-7-31(66-55(94)39(27-78)71-57(96)40-13-16-59-48-35(65-44(83)11-12-47(86)87)19-30-20-42(81)43(82)21-41(30)74(40)48)49(88)61-22-45(84)64-33(9-5-17-72(97)28-79)53(92)70-38(26-77)56(95)69-37(25-76)51(90)62-23-46(85)63-32-8-2-4-15-60-50(89)36(24-75)68-54(93)34(67-52(32)91)10-6-18-73(98)29-80;/h19-21,28-29,31-34,36-40,75-78H,1-18,22-27,58H2,(H15,59,60,61,62,63,64,65,66,67,68,69,70,71,81,82,83,84,85,86,87,88,89,90,91,92,93,94,95,96);/q-2;+7/p+1
InChIKey	XVLOTPQUGADDFF-UHFFFAOYSA-O
Composition	Polymer Sequences: DSN-LYS-GLY-FHO-SER-DSN-GLY-LYS-FH7-SER
BIRD class	METAL TRANSPORT
Represented As	POLYMER
Compound Details	n/a
Description	n/a

Chemical Details
Formal Charge	0
Atom Count	183
Chiral Atom Count	9
Bond Count	191
Aromatic Bond Count	11

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM133198.