Loading
PDBj
MenuPDBj@FacebookPDBj@TwitterPDBj@YouTubewwPDB FoundationwwPDB
RCSB PDBPDBeBMRBAdv. SearchSearch help

PRD_000404

Summary
Name:L-prolyl-L-leucyl-N-hydroxyglycinamide
Formula:C13 H24 N4 O4
Fomular weight:300.354
Component type:peptide-like
Polymer sequences:PRO, LEU, GLY, HOA
Non-polymer components:
BIRD class:Inhibitor
Represented as:polymer

ProgramVersionName
ACDLabs12.01L-prolyl-L-leucyl-N-hydroxyglycinamide
OpenEye OEToolkits1.7.6(2S)-N-[(2S)-4-methyl-1-[[2-(oxidanylamino)-2-oxidanylidene-ethyl]amino]-1-oxidanylidene-pentan-2-yl]pyrrolidine-2-carboxamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C(NC(C(=O)NCC(=O)NO)CC(C)C)C1NCCC1
InChIInChI1.03InChI=1S/C13H24N4O4/c1-8(2)6-10(12(19)15-7-11(18)17-21)16-13(20)9-4-3-5-14-9/h8-10,14,21H,3-7H2,1-2H3,(H,15,19)(H,16,20)(H,17,18)
InChIKeyInChI1.03WFURCOXZZPMXOC-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.370CC(C)C[C@@H](NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)NO
SMILESCACTVS3.370CC(C)C[CH](NC(=O)[CH]1CCCN1)C(=O)NCC(=O)NO
SMILES_CANONICALOpenEye OEToolkits1.7.6CC(C)C[C@@H](C(=O)NCC(=O)NO)NC(=O)[C@@H]1CCCN1
SMILESOpenEye OEToolkits1.7.6CC(C)CC(C(=O)NCC(=O)NO)NC(=O)C1CCCN1

218853

PDB entries from 2024-04-24

PDB statisticsPDBj update infoContact PDBjnumon