5EDE
CRYSTAL STRUCTURE OF HUMAN PHOSPHODIESTERASE 10 IN COMPLEX WITH c13c(cc(s1)C(NCC2OCCC2)=O)c(nn3c4ccc(cc4)Cl)C, micromolar IC50=0.217
Functional Information from GO Data
| Chain | GOid | namespace | contents |
| A | 0004114 | molecular_function | 3',5'-cyclic-nucleotide phosphodiesterase activity |
| A | 0007165 | biological_process | signal transduction |
| A | 0008081 | molecular_function | phosphoric diester hydrolase activity |
| B | 0004114 | molecular_function | 3',5'-cyclic-nucleotide phosphodiesterase activity |
| B | 0007165 | biological_process | signal transduction |
| B | 0008081 | molecular_function | phosphoric diester hydrolase activity |
| C | 0004114 | molecular_function | 3',5'-cyclic-nucleotide phosphodiesterase activity |
| C | 0007165 | biological_process | signal transduction |
| C | 0008081 | molecular_function | phosphoric diester hydrolase activity |
| D | 0004114 | molecular_function | 3',5'-cyclic-nucleotide phosphodiesterase activity |
| D | 0007165 | biological_process | signal transduction |
| D | 0008081 | molecular_function | phosphoric diester hydrolase activity |
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 6 |
| Details | binding site for residue ZN A 801 |
| Chain | Residue |
| A | HIS529 |
| A | HIS563 |
| A | ASP564 |
| A | ASP674 |
| A | HOH970 |
| A | HOH1016 |
| site_id | AC2 |
| Number of Residues | 6 |
| Details | binding site for residue MG A 802 |
| Chain | Residue |
| A | HOH975 |
| A | HOH978 |
| A | HOH1048 |
| A | ASP564 |
| A | HOH931 |
| A | HOH970 |
| site_id | AC3 |
| Number of Residues | 6 |
| Details | binding site for residue GOL A 803 |
| Chain | Residue |
| A | PRO481 |
| A | PHE482 |
| A | GLU483 |
| A | ASN484 |
| B | ARG520 |
| B | ARG568 |
| site_id | AC4 |
| Number of Residues | 9 |
| Details | binding site for residue 5M6 A 804 |
| Chain | Residue |
| A | LEU675 |
| A | SER677 |
| A | VAL678 |
| A | MET713 |
| A | MET714 |
| A | GLN726 |
| A | PHE729 |
| A | HOH981 |
| A | HOH1026 |
| site_id | AC5 |
| Number of Residues | 6 |
| Details | binding site for residue ZN B 801 |
| Chain | Residue |
| B | HIS529 |
| B | HIS563 |
| B | ASP564 |
| B | ASP674 |
| B | HOH919 |
| B | HOH1010 |
| site_id | AC6 |
| Number of Residues | 6 |
| Details | binding site for residue MG B 802 |
| Chain | Residue |
| B | ASP564 |
| B | HOH919 |
| B | HOH924 |
| B | HOH972 |
| B | HOH977 |
| B | HOH1040 |
| site_id | AC7 |
| Number of Residues | 6 |
| Details | binding site for residue GOL B 803 |
| Chain | Residue |
| B | PRO481 |
| B | GLU483 |
| B | ASN484 |
| C | ARG520 |
| C | ARG568 |
| C | PHE570 |
| site_id | AC8 |
| Number of Residues | 11 |
| Details | binding site for residue 5M6 B 804 |
| Chain | Residue |
| B | SER573 |
| B | LEU675 |
| B | SER677 |
| B | VAL678 |
| B | ILE692 |
| B | MET713 |
| B | MET714 |
| B | GLN726 |
| B | PHE729 |
| B | HOH923 |
| B | HOH954 |
| site_id | AC9 |
| Number of Residues | 6 |
| Details | binding site for residue ZN C 801 |
| Chain | Residue |
| C | HIS529 |
| C | HIS563 |
| C | ASP564 |
| C | ASP674 |
| C | HOH950 |
| C | HOH963 |
| site_id | AD1 |
| Number of Residues | 6 |
| Details | binding site for residue MG C 802 |
| Chain | Residue |
| C | ASP564 |
| C | HOH935 |
| C | HOH946 |
| C | HOH950 |
| C | HOH956 |
| C | HOH1036 |
| site_id | AD2 |
| Number of Residues | 11 |
| Details | binding site for residue 5M6 C 803 |
| Chain | Residue |
| C | TYR524 |
| C | SER573 |
| C | LEU635 |
| C | LEU675 |
| C | SER677 |
| C | VAL678 |
| C | ILE692 |
| C | MET713 |
| C | GLN726 |
| C | PHE729 |
| C | HOH962 |
| site_id | AD3 |
| Number of Residues | 6 |
| Details | binding site for residue ZN D 801 |
| Chain | Residue |
| D | HIS529 |
| D | HIS563 |
| D | ASP564 |
| D | ASP674 |
| D | HOH939 |
| D | HOH955 |
| site_id | AD4 |
| Number of Residues | 6 |
| Details | binding site for residue MG D 802 |
| Chain | Residue |
| D | ASP564 |
| D | HOH905 |
| D | HOH934 |
| D | HOH939 |
| D | HOH988 |
| D | HOH993 |
| site_id | AD5 |
| Number of Residues | 10 |
| Details | binding site for residue 5M6 D 803 |
| Chain | Residue |
| D | PHE729 |
| D | HOH902 |
| D | SER573 |
| D | LEU635 |
| D | LEU675 |
| D | SER677 |
| D | VAL678 |
| D | ILE692 |
| D | MET713 |
| D | GLN726 |
Functional Information from PROSITE/UniProt
| site_id | PS00126 |
| Number of Residues | 12 |
| Details | PDEASE_I_1 3'5'-cyclic nucleotide phosphodiesterase domain signature. HDLdHrGfsNsY |
| Chain | Residue | Details |
| B | HIS563-TYR574 | |
| A | HIS563-TYR574 |
Functional Information from SwissProt/UniProt
| site_id | SWS_FT_FI1 |
| Number of Residues | 4 |
| Details | Active site: {"description":"Proton donor","evidences":[{"source":"UniProtKB","id":"O76083","evidenceCode":"ECO:0000250"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI2 |
| Number of Residues | 24 |
| Details | Binding site: {"evidences":[{"source":"PubMed","id":"17389385","evidenceCode":"ECO:0000269"}]} |
| Chain | Residue | Details |
