4XIT
Discovery of novel oxazepine and diazepine carboxamides as two new classes of heat shock protein 90 inhibitors
Functional Information from GO Data
Functional Information from PDB Data
site_id | AC1 |
Number of Residues | 15 |
Details | binding site for residue 40Z A 301 |
Chain | Residue |
A | ALA55 |
A | THR184 |
A | VAL186 |
A | GOL302 |
A | HOH448 |
A | HOH508 |
A | HOH536 |
A | LYS58 |
A | TYR61 |
A | ASP93 |
A | MET98 |
A | LEU107 |
A | GLY135 |
A | TYR139 |
A | TRP162 |
site_id | AC2 |
Number of Residues | 9 |
Details | binding site for residue GOL A 302 |
Chain | Residue |
A | ASP102 |
A | LEU103 |
A | ILE104 |
A | LEU107 |
A | GLY108 |
A | TYR139 |
A | TRP162 |
A | PHE170 |
A | 40Z301 |
Functional Information from PROSITE/UniProt
site_id | PS00298 |
Number of Residues | 10 |
Details | HSP90 Heat shock hsp90 proteins family signature. YsNKEIFLRE |
Chain | Residue | Details |
A | TYR38-GLU47 |
Functional Information from SwissProt/UniProt
site_id | SWS_FT_FI1 |
Number of Residues | 1 |
Details | BINDING: |
Chain | Residue | Details |
A | GLU16 |
site_id | SWS_FT_FI2 |
Number of Residues | 1 |
Details | MOD_RES: Phosphoserine => ECO:0000269|PubMed:2492519, ECO:0007744|PubMed:17081983, ECO:0007744|PubMed:18318008, ECO:0007744|PubMed:23186163, ECO:0007744|PubMed:24275569 |
Chain | Residue | Details |
A | THR109 |
site_id | SWS_FT_FI3 |
Number of Residues | 1 |
Details | MOD_RES: Phosphoserine => ECO:0007744|PubMed:18088087, ECO:0007744|PubMed:21406692, ECO:0007744|PubMed:23186163 |
Chain | Residue | Details |
A | MET130 |
site_id | SWS_FT_FI4 |
Number of Residues | 1 |
Details | MOD_RES: Phosphoserine => ECO:0000269|PubMed:2492519, ECO:0007744|PubMed:16807684, ECO:0007744|PubMed:17081983, ECO:0007744|PubMed:18088087, ECO:0007744|PubMed:18318008, ECO:0007744|PubMed:18669648, ECO:0007744|PubMed:18691976, ECO:0007744|PubMed:19367720, ECO:0007744|PubMed:23186163 |
Chain | Residue | Details |
A | ALA141 |
site_id | SWS_FT_FI5 |
Number of Residues | 1 |
Details | MOD_RES: Phosphotyrosine => ECO:0000250|UniProtKB:P07901 |
Chain | Residue | Details |
A | LYS191 |