4JLG
SETD7 in complex with inhibitor (R)-PFI-2 and S-adenosyl-methionine
Functional Information from GO Data
| Chain | GOid | namespace | contents |
| A | 0005694 | cellular_component | chromosome |
| A | 0006355 | biological_process | regulation of DNA-templated transcription |
| A | 0016279 | molecular_function | protein-lysine N-methyltransferase activity |
| A | 0140945 | molecular_function | histone H3K4 monomethyltransferase activity |
| B | 0005694 | cellular_component | chromosome |
| B | 0006355 | biological_process | regulation of DNA-templated transcription |
| B | 0016279 | molecular_function | protein-lysine N-methyltransferase activity |
| B | 0140945 | molecular_function | histone H3K4 monomethyltransferase activity |
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 21 |
| Details | BINDING SITE FOR RESIDUE SAM A 401 |
| Chain | Residue |
| A | SER225 |
| A | HIS297 |
| A | TYR335 |
| A | TRP352 |
| A | GLU356 |
| A | 1L8402 |
| A | HOH513 |
| A | HOH535 |
| A | HOH563 |
| A | HOH567 |
| A | HOH574 |
| A | ALA226 |
| A | HOH583 |
| A | HOH695 |
| A | GLU228 |
| A | GLY264 |
| A | ASN265 |
| A | HIS293 |
| A | LYS294 |
| A | ALA295 |
| A | ASN296 |
| site_id | AC2 |
| Number of Residues | 15 |
| Details | BINDING SITE FOR RESIDUE 1L8 A 402 |
| Chain | Residue |
| A | TYR245 |
| A | HIS252 |
| A | VAL255 |
| A | ASP256 |
| A | THR266 |
| A | LEU267 |
| A | SER268 |
| A | TYR305 |
| A | TYR335 |
| A | GLY336 |
| A | TYR337 |
| A | HIS339 |
| A | SER340 |
| A | SAM401 |
| A | HOH658 |
| site_id | AC3 |
| Number of Residues | 21 |
| Details | BINDING SITE FOR RESIDUE SAM B 401 |
| Chain | Residue |
| B | SER225 |
| B | ALA226 |
| B | GLU228 |
| B | GLY264 |
| B | ASN265 |
| B | HIS293 |
| B | LYS294 |
| B | ALA295 |
| B | ASN296 |
| B | HIS297 |
| B | TYR335 |
| B | TRP352 |
| B | GLU356 |
| B | 1L8402 |
| B | HOH519 |
| B | HOH535 |
| B | HOH559 |
| B | HOH563 |
| B | HOH584 |
| B | HOH607 |
| B | HOH619 |
| site_id | AC4 |
| Number of Residues | 18 |
| Details | BINDING SITE FOR RESIDUE 1L8 B 402 |
| Chain | Residue |
| B | TYR245 |
| B | HIS252 |
| B | VAL255 |
| B | ASP256 |
| B | TRP260 |
| B | GLY264 |
| B | THR266 |
| B | LEU267 |
| B | SER268 |
| B | VAL274 |
| B | TYR305 |
| B | TYR335 |
| B | GLY336 |
| B | TYR337 |
| B | HIS339 |
| B | SER340 |
| B | SAM401 |
| B | HOH542 |
Functional Information from SwissProt/UniProt
| site_id | SWS_FT_FI1 |
| Number of Residues | 6 |
| Details | BINDING: BINDING => ECO:0000269|PubMed:12514135, ECO:0000269|PubMed:12540855 |
| Chain | Residue | Details |
| A | ALA226 | |
| A | ASN296 | |
| A | HIS297 | |
| B | ALA226 | |
| B | ASN296 | |
| B | HIS297 |
| site_id | SWS_FT_FI2 |
| Number of Residues | 2 |
| Details | BINDING: BINDING => ECO:0000255|PROSITE-ProRule:PRU00190, ECO:0000269|PubMed:12514135, ECO:0000269|PubMed:12540855 |
| Chain | Residue | Details |
| A | GLU356 | |
| B | GLU356 |
| site_id | SWS_FT_FI3 |
| Number of Residues | 10 |
| Details | SITE: Histone H3K4 binding => ECO:0000269|PubMed:12540855 |
| Chain | Residue | Details |
| A | TYR245 | |
| B | TYR335 | |
| A | ASP256 | |
| A | THR266 | |
| A | LYS317 | |
| A | TYR335 | |
| B | TYR245 | |
| B | ASP256 | |
| B | THR266 | |
| B | LYS317 |
Catalytic Information from CSA
| site_id | MCSA1 |
| Number of Residues | 5 |
| Details | M-CSA 350 |
| Chain | Residue | Details |
| A | TYR245 | activator, electrostatic stabiliser, hydrogen bond acceptor, hydrogen bond donor |
| A | HIS293 | electrostatic stabiliser, hydrogen bond acceptor |
| A | HIS297 | electrostatic stabiliser, hydrogen bond acceptor |
| A | TYR305 | activator, electrostatic stabiliser, hydrogen bond acceptor |
| A | TYR335 | activator, electrostatic stabiliser, hydrogen bond acceptor, hydrogen bond donor, proton acceptor, proton donor |
| site_id | MCSA2 |
| Number of Residues | 5 |
| Details | M-CSA 350 |
| Chain | Residue | Details |
| B | TYR245 | activator, electrostatic stabiliser, hydrogen bond acceptor, hydrogen bond donor |
| B | HIS293 | electrostatic stabiliser, hydrogen bond acceptor |
| B | HIS297 | electrostatic stabiliser, hydrogen bond acceptor |
| B | TYR305 | activator, electrostatic stabiliser, hydrogen bond acceptor |
| B | TYR335 | activator, electrostatic stabiliser, hydrogen bond acceptor, hydrogen bond donor, proton acceptor, proton donor |
