PRD_000824

SLKIDNED peptide

PRD_000824 is described in the Biologically Interesting Molecule Reference Dictionary (BIRD).

The representative PDB ID is 3AVK.

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Chemical Component Summary
Name	SLKIDNED peptide
Identifiers	4-[(2S,5S,8S,11S,14S,17S,20S,23S)-11-(2-azanyl-2-oxidanylidene-ethyl)-5-[(2S)-butan-2-yl]-20-(hydroxymethyl)-8,17-bis(2-hydroxy-2-oxoethyl)-14-(3-hydroxy-3-oxopropyl)-23-(2-methylpropyl)-3,6,9,12,15,18,21,24-octakis(oxidanylidene)-1,4,7,10,13,16,19,22-octazacyclotetracos-2-yl]butylazanium
Formula	C₃₈ H₆₃ N₁₀ O₁₆
Molecular Weight	915.964
Type	PEPTIDE-LIKE
Isomeric SMILES	CC[C@H](C)[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CCCC[NH3+])CC(C)C)CO)CC(=O)O)CCC(=O)O)CC(=O)N)CC(=O)O
InChI	InChI=1S/C38H62N10O16/c1-5-18(4)30-38(64)46-24(15-29(55)56)35(61)44-22(13-26(40)50)34(60)42-20(9-10-27(51)52)31(57)45-23(14-28(53)54)36(62)47-25(16-49)37(63)43-21(12-17(2)3)33(59)41-19(32(58)48-30)8-6-7-11-39/h17-25,30,49H,5-16,39H2,1-4H3,(H2,40,50)(H,41,59)(H,42,60)(H,43,63)(H,44,61)(H,45,57)(H,46,64)(H,47,62)(H,48,58)(H,51,52)(H,53,54)(H,55,56)/p+1/t18-,19?,20?,21?,22?,23?,24-,25?,30-/m0/s1
InChIKey	IWOCGMWDCLGDRK-JXMQUJSMSA-O
Composition	Polymer Sequences: SER-LEU-LYS-ILE-ASP-ASN-GLU-ASP
BIRD class	ENZYME INHIBITOR
Represented As	POLYMER
Compound Details	n/a
Description	n/a

Chemical Details
Formal Charge	0
Atom Count	127
Chiral Atom Count	9
Bond Count	127
Aromatic Bond Count	0

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.