Ligand name: Biotin
PDB ligand accession: BTN
DrugBank: DB00121
InChI Key: YBJHBAHKTGYVGT-ZKWXMUAHSA-N
SMILES: C1C2C(C(S1)CCCCC(=O)O)NC(=O)N2
Drug action: cofactor

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Biotin and derivatives
      • Subclass: None

List of drug binding-associated PTMs

List of PDB structures and/or AlphaFold models with target protein O00763

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name
O00763	Download	Predicted	O00763_F1_nD6 O00763_F1_nD3 O00763_F1_nD9 O00763_F1_nD1 O00763_F1_nD2	Repetitive alpha hairpins alpha/beta-Hammerhead/Barrel-sandwich hybrid ClpP/crotonase Rossmann-like Protein kinase/SAICAR synthase/ATP-grasp
2DN8		Predicted	e2dn8A1
2HJW		Predicted	e2hjwA1 e2hjwA3 e2hjwA2
2KCC		Predicted	e2kccA1
3FF6		Predicted	e3ff6B2 e3ff6D1 e3ff6B1 e3ff6D2 e3ff6A1 e3ff6A2 e3ff6C1 e3ff6C2
3GID		Predicted	e3gidA2 e3gidB2 e3gidA3 e3gidB3 e3gidA4 e3gidB4
3GLK		Predicted	e3glkA3 e3glkA2 e3glkA1
3JRW		Predicted	e3jrwA1 e3jrwA3 e3jrwA2
3JRX		Predicted	e3jrxA1 e3jrxA3 e3jrxA2
3TDC		Predicted	e3tdcA1 e3tdcA2
4HQ6		Predicted	e4hq6A1 e4hq6A3 e4hq6A2
5KKN		Predicted	e5kknB3 e5kknC3 e5kknB2 e5kknC2 e5kknB1 e5kknC1