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Ligand · XTC

XTC · (4S,4aS,5aR,12aS)-4-(dimethylamino)-3,10,12,12a-tetrahydroxy-9-nitro-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide

XTC, (4S,4aS,5aR,12aS)-4-(dimethylamino)-3,10,12,12a-tetrahydroxy-9-nitro-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide (C21 H21 N3 O9, 459.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB…

Component
XTC
Formula
C21 H21 N3 O9
Class
ligand
Structures
2
PDB entries
1

Binding sites

XTC in 2 structures; the first of them:

  • 4AUX · Tet repressor class D in complex with 9-nitrotetracycline · XTC A222 · binds LEU60, HIS64, SER67, ASN82, PHE86, HIS100, THR103, ARG104 and 8 more
  • 4AUX · Tet repressor class D in complex with 9-nitrotetracycline · XTC A222 · binds LEU60, HIS64, SER67, ASN82, PHE86, HIS100, THR103, ARG104 and 8 more

Residues it binds most

GLN 2, HIS 2, LEU 2, SER 2, THR 2, ARG 2, ASN 2, ILE 2, PHE 2, PRO 2 (residue and the binding sites it lines).

Found with

  • MG · Magnesium ion
  • CL · Chloride ion

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