Ligand · A1LU4
A1LU4 · 2-[(2~{R},5~{R},8~{S},11~{S})-11-(3-carbamimidamidopropyl)-7-methyl-3,6,9,12,15-pentakis(oxidanylidene)-5-(phenylmethyl)-8-propan-2-yl-1,4,7,10,13-pentazacyclopentadec-2-yl]ethanoic acid
A1LU4, 2-[(2~{R},5~{R},8~{S},11~{S})-11-(3-carbamimidamidopropyl)-7-methyl-3,6,9,12,15-pentakis(oxidanylidene)-5-(phenylmethyl)-8-propan-2-yl-1,4,7,10,13-pentazacyclopentadec-2-yl]ethanoic acid (C27 H40 N8 O7, 588.7 g/mol), in the MolNFT…
- Component
- A1LU4
- Formula
- C27 H40 N8 O7
- Class
- ligand
- Structures
- 2
- PDB entries
- 2
Binding sites
A1LU4 in 2 structures; the first of them:
- 8XER · Cryo-EM structure of integrin ITGAV, ITGB3 and Cilengitide TFA complex, conformation 1 · A1LU4 B801 · binds ASP180, PHE207, TYR208, GLN210, THR242, ALA243, GLN244, ALA245 and 10 more
- 8XF6 · Cryo-EM structure of integrin ITGAV, ITGB3 and Cilengitide TFA complex, conformation 2 · A1LU4 B801 · binds ASP180, PHE207, TYR208, GLN210, ALA245, ASP248, SER147, TYR148 and 8 more
Residues it binds most
ASP 2, ALA 2, ARG 2, SER 2, TYR 2, GLN 2, ASN 2, GLU 2, PHE 2, THR 1 (residue and the binding sites it lines).
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