6HXL
Structure of the citryl-CoA lyase core module of human ATP citrate lyase in complex with citrate and CoASH (space group P21)
Functional Information from GO Data
| Chain | GOid | namespace | contents |
| A | 0046912 | molecular_function | acyltransferase activity, acyl groups converted into alkyl on transfer |
| B | 0046912 | molecular_function | acyltransferase activity, acyl groups converted into alkyl on transfer |
| C | 0046912 | molecular_function | acyltransferase activity, acyl groups converted into alkyl on transfer |
| D | 0046912 | molecular_function | acyltransferase activity, acyl groups converted into alkyl on transfer |
| E | 0046912 | molecular_function | acyltransferase activity, acyl groups converted into alkyl on transfer |
| F | 0046912 | molecular_function | acyltransferase activity, acyl groups converted into alkyl on transfer |
| G | 0046912 | molecular_function | acyltransferase activity, acyl groups converted into alkyl on transfer |
| H | 0046912 | molecular_function | acyltransferase activity, acyl groups converted into alkyl on transfer |
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 25 |
| Details | binding site for residue COA A 1200 |
| Chain | Residue |
| A | ASP933 |
| A | ARG976 |
| A | LYS1018 |
| A | ASN1020 |
| A | LEU1021 |
| A | ASN1024 |
| A | ASP1026 |
| A | FLC1201 |
| A | HOH1305 |
| A | HOH1343 |
| A | HOH1352 |
| A | ARG934 |
| A | HOH1363 |
| A | HOH1374 |
| A | HOH1395 |
| A | HOH1419 |
| A | HOH1420 |
| A | HOH1453 |
| A | ALA938 |
| A | LEU969 |
| A | ILE970 |
| A | GLY972 |
| A | ILE973 |
| A | GLY974 |
| A | HIS975 |
| site_id | AC2 |
| Number of Residues | 13 |
| Details | binding site for residue FLC A 1201 |
| Chain | Residue |
| A | HIS900 |
| A | VAL904 |
| A | PHE935 |
| A | GLY936 |
| A | HIS975 |
| A | ARG986 |
| A | VAL1025 |
| A | ASP1026 |
| A | ARG1065 |
| A | COA1200 |
| A | HOH1397 |
| A | HOH1411 |
| B | ARG1085 |
| site_id | AC3 |
| Number of Residues | 25 |
| Details | binding site for residue COA B 1201 |
| Chain | Residue |
| B | ASP933 |
| B | ARG934 |
| B | ALA938 |
| B | LYS964 |
| B | LEU969 |
| B | ILE970 |
| B | GLY972 |
| B | ILE973 |
| B | GLY974 |
| B | HIS975 |
| B | ARG976 |
| B | LYS1018 |
| B | ASN1020 |
| B | LEU1021 |
| B | ASN1024 |
| B | ASP1026 |
| B | FLC1202 |
| B | HOH1301 |
| B | HOH1332 |
| B | HOH1337 |
| B | HOH1391 |
| B | HOH1394 |
| B | HOH1396 |
| B | HOH1407 |
| B | HOH1458 |
| site_id | AC4 |
| Number of Residues | 13 |
| Details | binding site for residue FLC B 1202 |
| Chain | Residue |
| A | ARG1085 |
| B | HIS900 |
| B | VAL904 |
| B | PHE935 |
| B | GLY936 |
| B | HIS975 |
| B | ARG986 |
| B | VAL1025 |
| B | ASP1026 |
| B | ARG1065 |
| B | COA1201 |
| B | HOH1309 |
| B | HOH1401 |
| site_id | AC5 |
| Number of Residues | 5 |
| Details | binding site for residue PEG B 1203 |
| Chain | Residue |
| B | GLN888 |
| B | GLU891 |
| B | TYR993 |
| B | HOH1341 |
| C | HOH1337 |
| site_id | AC6 |
| Number of Residues | 22 |
| Details | binding site for residue COA C 1200 |
| Chain | Residue |
| C | HOH1406 |
| C | HOH1413 |
| C | HOH1419 |
| C | HOH1425 |
| C | ASP933 |
| C | ARG934 |
| C | ALA938 |
| C | LYS964 |
| C | ILE970 |
| C | GLY972 |
| C | ILE973 |
| C | GLY974 |
| C | HIS975 |
| C | ARG976 |
| C | LYS1018 |
| C | ASN1020 |
| C | LEU1021 |
| C | ASN1024 |
| C | ASP1026 |
| C | FLC1201 |
| C | HOH1336 |
| C | HOH1405 |
| site_id | AC7 |
| Number of Residues | 13 |
| Details | binding site for residue FLC C 1201 |
| Chain | Residue |
| C | HIS900 |
| C | VAL904 |
| C | PHE935 |
| C | GLY936 |
| C | HIS975 |
| C | ARG986 |
| C | VAL1025 |
| C | ASP1026 |
| C | ARG1065 |
| C | COA1200 |
| C | HOH1367 |
| C | HOH1426 |
| D | ARG1085 |
| site_id | AC8 |
| Number of Residues | 15 |
| Details | binding site for residue COA D 1201 |
| Chain | Residue |
| D | ILE970 |
| D | MET971 |
| D | GLY972 |
| D | ILE973 |
| D | GLY974 |
| D | LYS1017 |
| D | LYS1018 |
| D | ASN1020 |
| D | LEU1021 |
| D | HOH1317 |
| D | HOH1346 |
| D | HOH1361 |
| D | HOH1431 |
| D | HOH1447 |
| D | HOH1462 |
| site_id | AC9 |
| Number of Residues | 8 |
| Details | binding site for residue SO4 D 1202 |
| Chain | Residue |
| D | HIS900 |
| D | VAL904 |
| D | PHE935 |
| D | ARG1065 |
| D | HOH1306 |
| D | HOH1312 |
| D | HOH1414 |
| D | HOH1424 |
| site_id | AD1 |
| Number of Residues | 10 |
| Details | binding site for residue SO4 D 1203 |
| Chain | Residue |
| D | GLY849 |
| D | GLN850 |
| D | GLU851 |
| D | HOH1302 |
| D | HOH1321 |
| D | HOH1418 |
| D | HOH1429 |
| D | HOH1458 |
| E | ARG848 |
| H | HOH1376 |
| site_id | AD2 |
| Number of Residues | 23 |
| Details | binding site for residue COA E 1201 |
| Chain | Residue |
| E | ASP933 |
| E | ARG934 |
| E | ALA938 |
| E | LEU969 |
| E | ILE970 |
| E | MET971 |
| E | GLY972 |
| E | ILE973 |
| E | GLY974 |
| E | HIS975 |
| E | ARG976 |
| E | ASN1020 |
| E | LEU1021 |
| E | ASN1024 |
| E | ASP1026 |
| E | FLC1202 |
| E | HOH1324 |
| E | HOH1335 |
| E | HOH1370 |
| E | HOH1380 |
| E | HOH1384 |
| E | HOH1393 |
| E | HOH1428 |
| site_id | AD3 |
| Number of Residues | 13 |
| Details | binding site for residue FLC E 1202 |
| Chain | Residue |
| E | HIS900 |
| E | VAL904 |
| E | PHE935 |
| E | GLY936 |
| E | HIS975 |
| E | ARG986 |
| E | VAL1025 |
| E | ASP1026 |
| E | ARG1065 |
| E | COA1201 |
| E | HOH1333 |
| E | HOH1383 |
| G | ARG1085 |
| site_id | AD4 |
| Number of Residues | 3 |
| Details | binding site for residue PEG E 1203 |
| Chain | Residue |
| E | GLN888 |
| E | GLU891 |
| F | HOH1439 |
| site_id | AD5 |
| Number of Residues | 14 |
| Details | binding site for residue CAO F 1200 |
| Chain | Residue |
| F | ASP933 |
| F | GLY937 |
| F | ALA938 |
| F | LYS964 |
| F | ILE970 |
| F | MET971 |
| F | GLY972 |
| F | ILE973 |
| F | GLY974 |
| F | LYS1018 |
| F | ASN1020 |
| F | LEU1021 |
| F | HOH1420 |
| F | HOH1446 |
| site_id | AD6 |
| Number of Residues | 24 |
| Details | binding site for residue COA G 1200 |
| Chain | Residue |
| G | ASP933 |
| G | ARG934 |
| G | ALA938 |
| G | LEU969 |
| G | ILE970 |
| G | GLY972 |
| G | ILE973 |
| G | GLY974 |
| G | HIS975 |
| G | ARG976 |
| G | LYS1018 |
| G | ASN1020 |
| G | LEU1021 |
| G | ASN1024 |
| G | ASP1026 |
| G | FLC1201 |
| G | HOH1382 |
| G | HOH1385 |
| G | HOH1386 |
| G | HOH1389 |
| G | HOH1400 |
| G | HOH1442 |
| G | HOH1463 |
| G | HOH1465 |
| site_id | AD7 |
| Number of Residues | 13 |
| Details | binding site for residue FLC G 1201 |
| Chain | Residue |
| E | ARG1085 |
| G | HIS900 |
| G | VAL904 |
| G | PHE935 |
| G | GLY936 |
| G | HIS975 |
| G | ARG986 |
| G | VAL1025 |
| G | ASP1026 |
| G | ARG1065 |
| G | COA1200 |
| G | HOH1309 |
| G | HOH1410 |
| site_id | AD8 |
| Number of Residues | 15 |
| Details | binding site for residue COA H 1201 |
| Chain | Residue |
| H | LYS964 |
| H | ILE970 |
| H | MET971 |
| H | GLY972 |
| H | ILE973 |
| H | GLY974 |
| H | HIS975 |
| H | LYS1018 |
| H | ASN1020 |
| H | LEU1021 |
| H | HOH1322 |
| H | HOH1333 |
| H | HOH1349 |
| H | HOH1412 |
| H | HOH1505 |
| site_id | AD9 |
| Number of Residues | 6 |
| Details | binding site for residue EDO H 1202 |
| Chain | Residue |
| G | GLY868 |
| H | GLN888 |
| H | GLU891 |
| H | MET892 |
| H | HOH1304 |
| H | HOH1388 |
Functional Information from SwissProt/UniProt
| site_id | SWS_FT_FI1 |
| Number of Residues | 8 |
| Details | MOD_RES: Phosphoserine => ECO:0007744|PubMed:19369195 |
| Chain | Residue | Details |
| A | SER839 | |
| B | SER839 | |
| C | SER839 | |
| D | SER839 | |
| E | SER839 | |
| F | SER839 | |
| G | SER839 | |
| H | SER839 |
| site_id | SWS_FT_FI2 |
| Number of Residues | 24 |
| Details | MOD_RES: N6-acetyllysine => ECO:0007744|PubMed:19608861 |
| Chain | Residue | Details |
| A | LYS948 | |
| D | LYS948 | |
| D | LYS968 | |
| D | LYS1077 | |
| E | LYS948 | |
| E | LYS968 | |
| E | LYS1077 | |
| F | LYS948 | |
| F | LYS968 | |
| F | LYS1077 | |
| G | LYS948 | |
| A | LYS968 | |
| G | LYS968 | |
| G | LYS1077 | |
| H | LYS948 | |
| H | LYS968 | |
| H | LYS1077 | |
| A | LYS1077 | |
| B | LYS948 | |
| B | LYS968 | |
| B | LYS1077 | |
| C | LYS948 | |
| C | LYS968 | |
| C | LYS1077 |
| site_id | SWS_FT_FI3 |
| Number of Residues | 8 |
| Details | MOD_RES: N6-acetyllysine => ECO:0000250|UniProtKB:Q91V92 |
| Chain | Residue | Details |
| A | LYS978 | |
| B | LYS978 | |
| C | LYS978 | |
| D | LYS978 | |
| E | LYS978 | |
| F | LYS978 | |
| G | LYS978 | |
| H | LYS978 |
| site_id | SWS_FT_FI4 |
| Number of Residues | 8 |
| Details | MOD_RES: Phosphoserine => ECO:0007744|PubMed:18669648, ECO:0007744|PubMed:19369195 |
| Chain | Residue | Details |
| A | SER1100 | |
| B | SER1100 | |
| C | SER1100 | |
| D | SER1100 | |
| E | SER1100 | |
| F | SER1100 | |
| G | SER1100 | |
| H | SER1100 |
