BioLiP

PDB

BioLiP

PDB CCD ID:

LTR

Number of entries in BioLiP:

Chemical formula:

C11 H12 N2 O2

InChI:

InChI=1/C11H12N2O2/c12-9(11(14)15)5-7-6-13-10-4-2-1-3-8(7)10/h1-4,6,9,13H,5,12H2,(H,14,15)/t9-/m0/s1/f/h14H

InChIKey:

QIVBCDIJIAJPQS-FKOBDKTLDJ

SMILES:

Software	SMILES
ACDLabs 10.04	O=C(O)C(N)Cc2c1ccccc1nc2
OpenEye OEToolkits 1.5.0	c1ccc2c(c1)c(c[nH]2)C[C@@H](C(=O)O)N
OpenEye OEToolkits 1.5.0	c1ccc2c(c1)c(c[nH]2)CC(C(=O)O)N
CACTVS 3.341	N[CH](Cc1c[nH]c2ccccc12)C(O)=O
CACTVS 3.341	N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O

Name:

L-TRYPTOPHAN

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).