Ligand · NB2
NB2 · (1R,2S,5S)-N-{(1Z,2S)-1-imino-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-6,6-dimethyl-3-[3-methyl-N-({1-[(2-methylpropane-2-sulfonyl)methyl]cyclohexyl}carbamoyl)-L-valyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide
NB2, (1R,2S,5S)-N-{(1Z,2S)-1-imino-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-6,6-dimethyl-3-[3-methyl-N-({1-[(2-methylpropane-2-sulfonyl)methyl]cyclohexyl}carbamoyl)-L-valyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide (C33 H56 N6 O6 S, 664.9…
- Component
- NB2
- Formula
- C33 H56 N6 O6 S
- Class
- ligand
- Structures
- 2
- PDB entries
- 1
Binding sites
NB2 in 2 structures; the first of them:
- 7TFR · Room temperature X-ray structure of SARS-CoV-2 main protease (3CL Mpro) in complex with… · NB2 A401 · binds HIS41, MET49, PHE140, LEU141, ASN142, GLY143, SER144, CYS145 and 14 more
- 7TFR · Room temperature X-ray structure of SARS-cov-2 main protease (3CL mpro) in complex with… · NB2 A401 · binds HIS41, MET49, PHE140, LEU141, ASN142, GLY143, SER144, CYS145 and 14 more
Residues it binds most
HIS 2, GLN 2, LEU 2, MET 2, ALA 2, ARG 2, ASN 2, ASP 2, CYS 2, GLU 2 (residue and the binding sites it lines).
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