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Ligand · E91

E91 · 4-[(E)-(9H-fluoren-9-ylidenehydrazinylidene)methyl]benzoic acid

E91, 4-[(E)-(9H-fluoren-9-ylidenehydrazinylidene)methyl]benzoic acid (C21 H14 N2 O2, 326.4 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues…

Component
E91
Formula
C21 H14 N2 O2
Class
ligand
Structures
4
PDB entries
2

Binding sites

E91 in 4 structures; the first of them:

  • 4RLK · Crystal structure of Z. mays CK2alpha in complex with the ATP-competitive inhibitor… · E91 A406 · binds ARG43, VAL45, GLY46, VAL53, ILE66, LYS68, VAL95, PHE113 and 8 more
  • 4RLL · Crystal structure of human CK2alpha in complex with the ATP-competitive inhibitor… · E91 A402 · binds LEU45, VAL53, VAL66, LYS68, GLU81, ILE95, PHE113, VAL116 and 5 more
  • 4RLK · Crystal structure of Z. mays CK2ALPHA in complex with the ATP- competitive inhibitor… · E91 A406 · binds ARG43, VAL45, GLY46, VAL53, ILE66, LYS68, VAL95, PHE113 and 8 more
  • 4RLL · Crystal structure of human CK2ALPHA in complex with the ATP- competitive inhibitor… · E91 A402 · binds LEU45, VAL53, VAL66, LYS68, GLU81, ILE95, PHE113, VAL116 and 5 more

Residues it binds most

VAL 4, ILE 4, ASN 4, ASP 4, LYS 4, MET 4, PHE 4, TRP 4, ARG 2, GLU 2 (residue and the binding sites it lines).

Found with

  • GOL · Glycerol
  • ACT · Acetate ion

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