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BioLiP

PDB CCD ID: IYY
Number of entries in BioLiP: 3
Chemical formula: C6 H12 N2 O4 S2
InChI: InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)/t3-,4-/m0/s1
InChIKey: LEVWYRKDKASIDU-IMJSIDKUSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7C([C@@H](C(=O)O)N)SSC[C@@H](C(=O)O)N
CACTVS 3.385N[CH](CSSC[CH](N)C(O)=O)C(O)=O
OpenEye OEToolkits 2.0.7C(C(C(=O)O)N)SSCC(C(=O)O)N
CACTVS 3.385N[C@@H](CSSC[C@H](N)C(O)=O)C(O)=O
Name:L-cystine;
(2R)-2-azanyl-3-[[(2R)-2-azanyl-3-oxidanyl-3-oxidanylidene-propyl]disulfanyl]propanoic acid
ChEMBL: CHEMBL590540
DrugBank: DB00138
ZINC: ZINC000001532673
Reference:
  • Chengxin Zhang, Xi Zhang, Peter L Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023).
  • Jianyi Yang, Ambrish Roy, and Yang Zhang. BioLiP: a semi-manually curated database for biologically relevant ligand-protein interactions, Nucleic Acids Research, 41: D1096-D1103 (2013) (download the PDF file).

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