4Q4C
Crystal structure of the catalytic domain of human diphosphoinositol pentakisphosphate kinase 2 (PPIP5K2) in complex with ADP and synthetic 1,5-(PP)2-IP4 (1,5-IP8)
Functional Information from GO Data
Chain | GOid | namespace | contents |
A | 0000829 | molecular_function | inositol heptakisphosphate kinase activity |
Functional Information from PDB Data
site_id | AC1 |
Number of Residues | 24 |
Details | BINDING SITE FOR RESIDUE ADP A 401 |
Chain | Residue |
A | ARG134 |
A | MET240 |
A | ASP246 |
A | PRO265 |
A | ASP309 |
A | LEU311 |
A | CYS320 |
A | ASP321 |
A | I8P402 |
A | MG403 |
A | MG404 |
A | PRO149 |
A | HOH522 |
A | HOH541 |
A | HOH548 |
A | HOH830 |
A | HOH831 |
A | VAL185 |
A | LYS187 |
A | HIS194 |
A | LEU211 |
A | GLU237 |
A | GLU238 |
A | PHE239 |
site_id | AC2 |
Number of Residues | 47 |
Details | BINDING SITE FOR RESIDUE I8P A 402 |
Chain | Residue |
A | LYS53 |
A | LYS54 |
A | HIS194 |
A | ARG213 |
A | LYS214 |
A | LYS248 |
A | ARG262 |
A | ARG273 |
A | ARG281 |
A | ASP309 |
A | ASP321 |
A | ASN323 |
A | SER326 |
A | LYS329 |
A | ADP401 |
A | MG403 |
A | MG404 |
A | MG406 |
A | HOH522 |
A | HOH551 |
A | HOH581 |
A | HOH584 |
A | HOH651 |
A | HOH660 |
A | HOH664 |
A | HOH674 |
A | HOH679 |
A | HOH700 |
A | HOH710 |
A | HOH718 |
A | HOH721 |
A | HOH722 |
A | HOH726 |
A | HOH729 |
A | HOH738 |
A | HOH756 |
A | HOH757 |
A | HOH763 |
A | HOH776 |
A | HOH779 |
A | HOH781 |
A | HOH794 |
A | HOH795 |
A | HOH805 |
A | HOH807 |
A | HOH811 |
A | HOH832 |
site_id | AC3 |
Number of Residues | 5 |
Details | BINDING SITE FOR RESIDUE MG A 403 |
Chain | Residue |
A | ASP321 |
A | ASN323 |
A | ADP401 |
A | I8P402 |
A | HOH830 |
site_id | AC4 |
Number of Residues | 5 |
Details | BINDING SITE FOR RESIDUE MG A 404 |
Chain | Residue |
A | ASP309 |
A | ASP321 |
A | ADP401 |
A | I8P402 |
A | HOH522 |
site_id | AC5 |
Number of Residues | 6 |
Details | BINDING SITE FOR RESIDUE MG A 405 |
Chain | Residue |
A | SER68 |
A | PHE70 |
A | ILE73 |
A | HOH637 |
A | HOH680 |
A | HOH770 |
site_id | AC6 |
Number of Residues | 5 |
Details | BINDING SITE FOR RESIDUE MG A 406 |
Chain | Residue |
A | I8P402 |
A | HOH660 |
A | HOH674 |
A | HOH718 |
A | HOH832 |
site_id | AC7 |
Number of Residues | 6 |
Details | BINDING SITE FOR RESIDUE MG A 407 |
Chain | Residue |
A | HOH612 |
A | HOH615 |
A | HOH645 |
A | HOH651 |
A | HOH714 |
A | HOH796 |
Functional Information from SwissProt/UniProt
site_id | SWS_FT_FI1 |
Number of Residues | 2 |
Details | BINDING: BINDING => ECO:0000269|PubMed:22119861, ECO:0007744|PDB:3T9C, ECO:0007744|PDB:3T9D, ECO:0007744|PDB:3T9E, ECO:0007744|PDB:3T9F |
Chain | Residue | Details |
A | LYS53 | |
A | LYS248 |
site_id | SWS_FT_FI2 |
Number of Residues | 4 |
Details | BINDING: BINDING => ECO:0000269|PubMed:22119861, ECO:0007744|PDB:3T54, ECO:0007744|PDB:3T7A, ECO:0007744|PDB:3T99, ECO:0007744|PDB:3T9A, ECO:0007744|PDB:3T9B, ECO:0007744|PDB:3T9C, ECO:0007744|PDB:3T9D, ECO:0007744|PDB:3T9E, ECO:0007744|PDB:3T9F |
Chain | Residue | Details |
A | ARG134 | |
A | LYS187 | |
A | HIS194 | |
A | GLU237 |
site_id | SWS_FT_FI3 |
Number of Residues | 1 |
Details | BINDING: BINDING => ECO:0000269|PubMed:22119861, ECO:0007744|PDB:3T9A, ECO:0007744|PDB:3T9B, ECO:0007744|PDB:3T9C, ECO:0007744|PDB:3T9D |
Chain | Residue | Details |
A | ARG213 |
site_id | SWS_FT_FI4 |
Number of Residues | 1 |
Details | BINDING: BINDING => ECO:0000269|PubMed:22119861, ECO:0007744|PDB:3T54, ECO:0007744|PDB:3T9A, ECO:0007744|PDB:3T9B, ECO:0007744|PDB:3T9C, ECO:0007744|PDB:3T9D |
Chain | Residue | Details |
A | ASP246 |
site_id | SWS_FT_FI5 |
Number of Residues | 1 |
Details | BINDING: BINDING => ECO:0000269|PubMed:22119861, ECO:0007744|PDB:3T9C, ECO:0007744|PDB:3T9E, ECO:0007744|PDB:3T9F |
Chain | Residue | Details |
A | ARG262 |
site_id | SWS_FT_FI6 |
Number of Residues | 1 |
Details | BINDING: BINDING => ECO:0000269|PubMed:22119861, ECO:0007744|PDB:3T54, ECO:0007744|PDB:3T7A |
Chain | Residue | Details |
A | SER264 |
site_id | SWS_FT_FI7 |
Number of Residues | 1 |
Details | BINDING: BINDING => ECO:0000269|PubMed:22119861, ECO:0007744|PDB:3T54, ECO:0007744|PDB:3T7A, ECO:0007744|PDB:3T99, ECO:0007744|PDB:3T9B, ECO:0007744|PDB:3T9C, ECO:0007744|PDB:3T9D, ECO:0007744|PDB:3T9E, ECO:0007744|PDB:3T9F |
Chain | Residue | Details |
A | ASP309 |
site_id | SWS_FT_FI8 |
Number of Residues | 1 |
Details | BINDING: BINDING => ECO:0000269|PubMed:22119861, ECO:0007744|PDB:3T54 |
Chain | Residue | Details |
A | ASP321 |
site_id | SWS_FT_FI9 |
Number of Residues | 1 |
Details | BINDING: BINDING => ECO:0000269|PubMed:22119861, ECO:0007744|PDB:3T9D, ECO:0007744|PDB:3T9E |
Chain | Residue | Details |
A | SER326 |
site_id | SWS_FT_FI10 |
Number of Residues | 1 |
Details | MOD_RES: Phosphoserine => ECO:0007744|PubMed:23186163 |
Chain | Residue | Details |
A | SER223 |