Ligand · 3S0
3S0 · (2R,5S)-5-[(carbamoyloxy)methyl]-2-[(R)-carboxy{[(2Z)-2-(furan-2-yl)-2-(methoxyimino)acetyl]amino}methyl]-5,6-dihydro-2H-1,3-thiazine-4-carboxylic acid
3S0, (2R,5S)-5-[(carbamoyloxy)methyl]-2-[(R)-carboxy{[(2Z)-2-(furan-2-yl)-2-(methoxyimino)acetyl]amino}methyl]-5,6-dihydro-2H-1,3-thiazine-4-carboxylic acid (C16 H18 N4 O9 S, 442.4 g/mol), in the MolNFT structures on GenesisL1: bound in 4…
- Component
- 3S0
- Formula
- C16 H18 N4 O9 S
- Class
- ligand
- Structures
- 4
- PDB entries
- 2
Binding sites
3S0 in 4 structures; the first of them:
- 4RL0 · Structural and mechanistic insights into NDM-1 catalyzed hydrolysis of cephalosporins · 3S0 A303 · binds ILE35, LEU65, MET67, VAL73, TRP93, HIS122, GLN123, ASP124 and 14 more
- 5O2E · Crystal structure of NDM-1 in complex with hydrolyzed cefuroxime - new refinement · 3S0 A304 · binds LEU65, MET67, TRP93, HIS122, GLN123, ASP124, GLU152, MET154 and 11 more
- 4RL0 · Structural and mechanistic insights into ndm-1 catalyzed hydrolysis of cephalosporins · 3S0 A303 · binds ILE35, LEU65, MET67, VAL73, TRP93, HIS122, GLN123, ASP124 and 14 more
- 5O2E · Crystal structure of ndm-1 in complex with hydrolyzed cefuroxime - new refinement · 3S0 A304 · binds LEU65, MET67, TRP93, HIS122, GLN123, ASP124, GLU152, MET154 and 11 more
Residues it binds most
HIS 8, LEU 8, GLY 8, MET 8, ASN 8, ASP 8, CYS 8, GLN 8, ILE 4, LYS 8 (residue and the binding sites it lines).
Found with
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