SEQ2FUN

FURNA

PDB CCD ID: VAL
Number of entries in FURNA: 4
Chemical formula: C5 H11 N O2
InChI: InChI=1S/C5H11NO2/c1-3(2)4(6)5(7)8/h3-4H,6H2,1-2H3,(H,7,8)/t4-/m0/s1
InChIKey: KZSNJWFQEVHDMF-BYPYZUCNSA-N
SMILES: O=C(O)C(N)C(C)C;
CC(C)C(C(=O)O)N;
CC(C)[C@@H](C(=O)O)N;
CC(C)[C@H](N)C(O)=O;
CC(C)[CH](N)C(O)=O
Name:VALINE
ChEMBL: CHEMBL43068
DrugBank: DB00161
ZINC: ZINC000000895099

Reference:
  • Chengxin Zhang, Lydia Freddolino (2024) "FURNA: a database for function annotations of RNA structures," PLOS Biology 22(7): e3002476.