Ligand · IP1
IP1 · Isopenicillin N
IP1, Isopenicillin N (C14 H21 N3 O6 S, 359.4 g/mol), in the MolNFT structures on GenesisL1: bound in 6 records (4 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found with it.
- Component
- IP1
- Formula
- C14 H21 N3 O6 S
- Class
- ligand
- Structures
- 6
- PDB entries
- 4
Binding sites
IP1 in 6 structures; the first of them:
- 6ZAO · Isopenicillin N synthase structure in complex with Fe and IPN exposed to dioxygen. · IP1 A405 · binds ARG87, TYR91, CYS104, SER183, VAL185, ILE187, TYR189, PHE211 and 12 more
- 6ZAQ · Room temperature XFEL Isopenicillin N synthase structure in complex with Fe and IPN after… · IP1 A403 · binds ARG87, TYR91, CYS104, SER183, VAL185, ILE187, TYR189, PHE211 and 11 more
- 8P46 · IPNS variant N252D in complex with Fe and IPN after O2 exposure · IP1 A406 · binds ARG87, TYR91, CYS104, SER183, VAL185, ILE187, TYR189, PHE211 and 12 more
- 6Y0P · Isopenicillin N synthase in complex with ipn and fe using ft-ssx methods · IP1 A402 · binds ARG87, TYR91, CYS104, SER183, ILE187, TYR189, PHE211, HIS214 and 9 more
- 6ZAO · Isopenicillin N synthase structure in complex with fe and ipn exposed to dioxygen. · IP1 A405 · binds ARG87, TYR91, CYS104, SER183, ILE187, TYR189, PHE211, HIS214 and 8 more
- 6ZAQ · Room temperature xfel isopenicillin N synthase structure in complex with fe and ipn after… · IP1 A403 · binds ARG87, TYR91, CYS104, SER183, ILE187, TYR189, PHE211, HIS214 and 7 more
Residues it binds most
LEU 6, PHE 6, SER 6, TYR 6, VAL 6, HIS 6, ARG 6, CYS 6, GLN 6, ILE 6 (residue and the binding sites it lines).
Found with
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