BioLiP

PDB

BioLiP

PDB CCD ID:

SVZ

Number of entries in BioLiP:

Chemical formula:

C6 H15 N2 O5 P

InChI:

InChI=1S/C6H15N2O5P/c1-4(2)8-14(11,12)13-3-5(7)6(9)10/h4-5H,3,7H2,1-2H3,(H,9,10)(H2,8,11,12)/t5-/m0/s1

InChIKey:

UFRVALQULWCEQX-YFKPBYRVSA-N

SMILES:

Software	SMILES
CACTVS 3.341	CC(C)N[P@](O)(=O)OC[C@H](N)C(O)=O
OpenEye OEToolkits 1.5.0	CC(C)NP(=O)(O)OCC(C(=O)O)N
ACDLabs 10.04	O=P(O)(OCC(N)C(=O)O)NC(C)C
OpenEye OEToolkits 1.5.0	CC(C)N[P@@](=O)(O)OC[C@@H](C(=O)O)N
CACTVS 3.341	CC(C)N[P](O)(=O)OC[CH](N)C(O)=O

Name:

O-[(S)-HYDROXY(ISOPROPYLAMINO)PHOSPHORYL]-L-SERINE

ZINC:

ZINC000058638655

Reference:

Chengxin Zhang, Xi Zhang, Lydia 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).