Ligand · TTC

TTC · (S)-10-[(dimethylamino)methyl]-4-ethyl-4,9-dihydroxy-1H-pyrano[3',4':6,7]inolizino[1,2-B]-quinoline-3, 14(4H,12H)-dione

TTC, (S)-10-[(dimethylamino)methyl]-4-ethyl-4,9-dihydroxy-1H-pyrano[3',4':6,7]inolizino[1,2-B]-quinoline-3, 14(4H,12H)-dione (C23 H23 N3 O5, 421.4 g/mol), in the MolNFT structures on GenesisL1: bound in 3 records (3 PDB entries). Every…

Component: TTC
Formula: C23 H23 N3 O5
Class: ligand
Structures: 3
PDB entries: 3

Binding sites

TTC in 3 structures; the first of them:

7NEZ · Structure of topotecan-bound ABCG2 · TTC A1201 · binds ASN436, PHE439, THR542, VAL546, MET549, THR435, PHE439, THR542 and 2 more
7OJH · ABCG2 topotecan turnover-1 state · TTC A702 · binds PHE432, THR435, ASN436, PHE439, MET549, ASN436, PHE439, SER440 and 2 more
7OJI · ABCG2 topotecan turnover-2 state · TTC A701 · binds THR435, PHE439, LEU539, THR542, MET549, PHE439, VAL546, MET549

Residues it binds most

PHE 3, MET 3, THR 3, VAL 3, ASN 2, LEU 1, SER 1 (residue and the binding sites it lines).

Found with

ATP · Adenosine-5'-triphosphate
CLR · Cholesterol
PLC · Diundecyl phosphatidyl choline
NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose

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