Ligand · URR

URR · N~2~-(ethoxycarbonyl)-N-{(1S,2S)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]-1-sulfanylpropan-2-yl}-L-leucinamide

URR, N~2~-(ethoxycarbonyl)-N-{(1S,2S)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]-1-sulfanylpropan-2-yl}-L-leucinamide (C24 H37 N3 O9 S2, 575.7 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site…

Component: URR
Formula: C24 H37 N3 O9 S2
Class: ligand
Structures: 1
PDB entries: 1

Binding sites

URR in 1 structure; the first of them:

8E5X · Crystal structure of SARS-CoV-2 3CL protease in complex with a dimethyl sulfinyl benzene… · URR A402 · binds HIS41, PHE140, LEU141, ASN142, GLY143, SER144, CYS145, HIS163 and 9 more

Residues it binds most

HIS 2, ASN 2, ASP 2, CYS 2, GLN 2, GLU 2, GLY 2, LEU 2, MET 2, PHE 2 (residue and the binding sites it lines).

Found with

UO9 · (2~{S})-2-[[(2~{S})-4-methyl-2-[[2-methyl-2-[oxidanyl(phenyl)-$l^{3}-sulfanyl]propoxy]carbonylamino]pentanoyl]amino]-1-oxidanyl-3-[(3~{S})-2-oxidanylidenepyrrolidin-3-yl]propane-1-sulfonic acid
PG4 · Tetraethylene glycol

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