PRD_001078

Peptide inhibitor MPT-DPP-DAR-G-DPN-NH2

PRD_001078 is described in the Biologically Interesting Molecule Reference Dictionary (BIRD).

The representative PDB ID is 4KS6.

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Chemical Component Summary
Name	Peptide inhibitor MPT-DPP-DAR-G-DPN-NH2
Identifiers	[azanyl-[[(4R)-5-[[2-[[(2R)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-2-oxidanylidene-ethyl]amino]-4-[[(2S)-2-azanyl-3-(3-sulfanylpropanoylamino)propanoyl]amino]-5-oxidanylidene-pentyl]amino]methylidene]azanium
Formula	C₂₃ H₃₈ N₉ O₅ S
Molecular Weight	552.67
Type	PEPTIDE-LIKE
Isomeric SMILES	c1ccc(cc1)C[C@H](C(=O)N)NC(=O)CNC(=O)[C@@H](CCCNC(=[NH2+])N)NC(=O)[C@H](CNC(=O)CCS)N
InChI	InChI=1S/C23H37N9O5S/c24-15(12-29-18(33)8-10-38)21(36)32-16(7-4-9-28-23(26)27)22(37)30-13-19(34)31-17(20(25)35)11-14-5-2-1-3-6-14/h1-3,5-6,15-17,38H,4,7-13,24H2,(H2,25,35)(H,29,33)(H,30,37)(H,31,34)(H,32,36)(H4,26,27,28)/p+1/t15-,16+,17+/m0/s1
InChIKey	KVSMZXZGQXJTRJ-GVDBMIGSSA-O
Composition	Polymer Sequences: MPT-DPP-DAR-GLY-DPN-NH2
BIRD class	INHIBITOR
Represented As	POLYMER
Compound Details	n/a
Description	n/a

Chemical Details
Formal Charge	0
Atom Count	76
Chiral Atom Count	3
Bond Count	76
Aromatic Bond Count	6

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.