1FBZ
Structure-based design of a novel, osteoclast-selective, nonpeptide Src SH2 inhibitor with in vivo anti-resorptive activity
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 14 |
| Details | BINDING SITE FOR RESIDUE CC1 A 150 |
| Chain | Residue |
| A | ARG12 |
| A | GLY93 |
| B | ARG217 |
| B | ARG285 |
| B | HIS286 |
| B | ASN289 |
| A | ARG32 |
| A | GLU35 |
| A | SER36 |
| A | HIS58 |
| A | TYR59 |
| A | LYS60 |
| A | ILE71 |
| A | SER72 |
| site_id | AC2 |
| Number of Residues | 15 |
| Details | BINDING SITE FOR RESIDUE CC1 B 350 |
| Chain | Residue |
| A | GLU1 |
| B | ARG212 |
| B | ARG232 |
| B | SER234 |
| B | GLU235 |
| B | SER236 |
| B | CYS242 |
| B | HIS258 |
| B | TYR259 |
| B | LYS260 |
| B | ARG262 |
| B | SER272 |
| B | ASP292 |
| B | GLY293 |
| B | LEU294 |
Functional Information from SwissProt/UniProt
| site_id | SWS_FT_FI1 |
| Number of Residues | 2 |
| Details | MOD_RES: Phosphothreonine => ECO:0007744|PubMed:19690332 |
| Chain | Residue | Details |
| A | THR37 | |
| B | THR237 |
| site_id | SWS_FT_FI2 |
| Number of Residues | 4 |
| Details | MOD_RES: Phosphoserine => ECO:0007744|PubMed:19690332 |
| Chain | Residue | Details |
| A | SER40 | |
| A | SER72 | |
| B | SER240 | |
| B | SER272 |
| site_id | SWS_FT_FI3 |
| Number of Residues | 2 |
| Details | MOD_RES: Phosphotyrosine => ECO:0000250|UniProtKB:P06240 |
| Chain | Residue | Details |
| A | TYR70 | |
| B | TYR270 |
