Ligand · AU1
AU1 · 5'-O-[(R)-hydroxy(phosphonoamino)phosphoryl]adenosine
AU1, 5'-O-[(R)-hydroxy(phosphonoamino)phosphoryl]adenosine (C10 H16 N6 O9 P2, 426.2 g/mol), in the MolNFT structures on GenesisL1: bound in 10 records (5 PDB entries). Every binding site with its residues within 4.5 Å, the residues it…
- Component
- AU1
- Formula
- C10 H16 N6 O9 P2
- Class
- ligand
- Structures
- 10
- PDB entries
- 5
Binding sites
AU1 in 10 structures; the first of them:
- 4BR0 · rat NTPDase2 in complex with Ca AMPNP · AU1 A1462 · binds GLY47, SER48, SER49, HIS50, THR122, ALA123, GLY124, GLU165 and 11 more
- 4BR7 · Legionella pneumophila NTPDase1 crystal form I, open, AMPNP complex · AU1 A1394 · binds THR53, LYS80, LYS82, GLY189, GLN231, THR232, GLY299, ASN302 and 6 more
- 4BRC · Legionella pneumophila NTPDase1 crystal form II, closed, Mg AMPNP complex · AU1 A1397 · binds ASP49, GLY51, SER52, THR53, GLY54, ARG56, THR118, ALA119 and 16 more
- 4KH5 · Toxoplasma gondii NTPDase1 C258S/C268S in complex with Mg and AMPNP · AU1 A700 · binds ASP70, GLY72, SER73, SER74, SER75, ARG77, THR188, ALA189 and 5 more
- 4KH6 · Toxoplasma gondii NTPDase1 C258S/C268S E493G crystallized with Mg and AMPNP · AU1 A700 · binds ASP70, GLY72, SER73, SER74, ARG77, THR188, GLY279, GLY280 and 8 more
- 4BR0 · Rat NTPDASE2 in complex with ca ampnp · AU1 A1462 · binds GLY47, SER48, SER49, HIS50, THR122, ALA123, GLY124, GLU165 and 11 more
- 4BR7 · Legionella pneumophila NTPDASE1 crystal form I, open, ampnp complex · AU1 A1394 · binds THR53, LYS80, LYS82, GLY189, GLN231, THR232, GLY299, ASN302 and 6 more
- 4BRC · Legionella pneumophila NTPDASE1 crystal form II, closed, mg ampnp complex · AU1 A1397 · binds ASP49, GLY51, SER52, THR53, GLY54, ARG56, THR118, ALA119 and 16 more
- 4KH5 · Toxoplasma gondii NTPDASE1 C258S/C268S in complex with mg and ampnp · AU1 A700 · binds ASP70, GLY72, SER73, SER74, SER75, ARG77, THR188, ALA189 and 5 more
- 4KH6 · Toxoplasma gondii NTPDASE1 C258S/C268S E493G crystallized with mg and ampnp · AU1 A700 · binds ASP70, GLY72, SER73, SER74, ARG77, THR188, GLY279, GLY280 and 8 more
Residues it binds most
GLY 16, SER 14, ALA 14, THR 16, ARG 14, TYR 8, LEU 10, ASP 14, GLU 12, MET 8 (residue and the binding sites it lines).
Found with
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