4R6E
Human artd1 (parp1) - catalytic domain in complex with inhibitor niraparib
Functional Information from GO Data
Functional Information from PDB Data
site_id | AC1 |
Number of Residues | 10 |
Details | BINDING SITE FOR RESIDUE 3JD A 1101 |
Chain | Residue |
A | ASP766 |
A | GOL1103 |
A | HIS862 |
A | GLY863 |
A | GLY888 |
A | TYR889 |
A | TYR896 |
A | PHE897 |
A | SER904 |
A | TYR907 |
site_id | AC2 |
Number of Residues | 5 |
Details | BINDING SITE FOR RESIDUE SO4 A 1102 |
Chain | Residue |
A | LYS903 |
A | LEU984 |
A | LEU985 |
A | TYR986 |
A | HOH1216 |
site_id | AC3 |
Number of Residues | 6 |
Details | BINDING SITE FOR RESIDUE GOL A 1103 |
Chain | Residue |
A | HIS862 |
A | TYR889 |
A | ILE895 |
A | TYR896 |
A | 3JD1101 |
A | HOH1206 |
site_id | AC4 |
Number of Residues | 11 |
Details | BINDING SITE FOR RESIDUE 3JD B 1101 |
Chain | Residue |
B | GLU763 |
B | ASP766 |
B | HIS862 |
B | GLY863 |
B | GLY888 |
B | TYR889 |
B | TYR896 |
B | PHE897 |
B | SER904 |
B | TYR907 |
B | GOL1103 |
site_id | AC5 |
Number of Residues | 4 |
Details | BINDING SITE FOR RESIDUE SO4 B 1102 |
Chain | Residue |
B | LYS903 |
B | LEU984 |
B | LEU985 |
B | TYR986 |
site_id | AC6 |
Number of Residues | 6 |
Details | BINDING SITE FOR RESIDUE GOL B 1103 |
Chain | Residue |
B | HIS862 |
B | TYR889 |
B | GLY894 |
B | ILE895 |
B | TYR896 |
B | 3JD1101 |
site_id | AC7 |
Number of Residues | 10 |
Details | BINDING SITE FOR RESIDUE 3JD C 1101 |
Chain | Residue |
C | ASP766 |
C | HIS862 |
C | GLY863 |
C | GLY888 |
C | TYR889 |
C | TYR896 |
C | PHE897 |
C | SER904 |
C | TYR907 |
C | GOL1103 |
site_id | AC8 |
Number of Residues | 5 |
Details | BINDING SITE FOR RESIDUE SO4 C 1102 |
Chain | Residue |
C | LYS903 |
C | LEU984 |
C | LEU985 |
C | TYR986 |
C | HOH1232 |
site_id | AC9 |
Number of Residues | 8 |
Details | BINDING SITE FOR RESIDUE GOL C 1103 |
Chain | Residue |
C | HIS862 |
C | TYR889 |
C | GLY894 |
C | ILE895 |
C | TYR896 |
C | 3JD1101 |
C | HOH1209 |
C | HOH1243 |
site_id | BC1 |
Number of Residues | 9 |
Details | BINDING SITE FOR RESIDUE 3JD D 1101 |
Chain | Residue |
D | ASP766 |
D | HIS862 |
D | GLY863 |
D | GLY888 |
D | TYR889 |
D | TYR896 |
D | PHE897 |
D | SER904 |
D | TYR907 |
site_id | BC2 |
Number of Residues | 4 |
Details | BINDING SITE FOR RESIDUE SO4 D 1102 |
Chain | Residue |
D | LYS903 |
D | LEU984 |
D | LEU985 |
D | TYR986 |
Functional Information from SwissProt/UniProt
site_id | SWS_FT_FI1 |
Number of Residues | 351 |
Details | Domain: {"description":"PARP alpha-helical","evidences":[{"source":"PROSITE-ProRule","id":"PRU00398","evidenceCode":"ECO:0000255"}]} |
Chain | Residue | Details |
site_id | SWS_FT_FI2 |
Number of Residues | 4 |
Details | Active site: {"description":"For poly [ADP-ribose] polymerase activity","evidences":[{"source":"PubMed","id":"32028527","evidenceCode":"ECO:0000305"},{"source":"PubMed","id":"7852410","evidenceCode":"ECO:0000305"},{"source":"PubMed","id":"9315851","evidenceCode":"ECO:0000305"}]} |
Chain | Residue | Details |
site_id | SWS_FT_FI3 |
Number of Residues | 20 |
Details | Binding site: {"evidences":[{"source":"UniProtKB","id":"Q9UGN5","evidenceCode":"ECO:0000250"}]} |
Chain | Residue | Details |
site_id | SWS_FT_FI4 |
Number of Residues | 4 |
Details | Modified residue: {"description":"Phosphoserine","evidences":[{"source":"PubMed","id":"18669648","evidenceCode":"ECO:0007744"},{"source":"PubMed","id":"19690332","evidenceCode":"ECO:0007744"},{"source":"PubMed","id":"20068231","evidenceCode":"ECO:0007744"},{"source":"PubMed","id":"21406692","evidenceCode":"ECO:0007744"},{"source":"PubMed","id":"23186163","evidenceCode":"ECO:0007744"}]} |
Chain | Residue | Details |
site_id | SWS_FT_FI5 |
Number of Residues | 4 |
Details | Modified residue: {"description":"Phosphoserine","evidences":[{"source":"PubMed","id":"23186163","evidenceCode":"ECO:0007744"}]} |
Chain | Residue | Details |
site_id | SWS_FT_FI6 |
Number of Residues | 8 |
Details | Cross-link: {"description":"Glycyl lysine isopeptide (Lys-Gly) (interchain with G-Cter in SUMO2); alternate","evidences":[{"source":"PubMed","id":"25218447","evidenceCode":"ECO:0007744"},{"source":"PubMed","id":"28112733","evidenceCode":"ECO:0007744"}]} |
Chain | Residue | Details |