Summary Structural details Experimental details Functional details Sequence Neighbor History Downloads

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	Modified residue: {"description":"Phosphoserine","evidences":[{"source":"PubMed","id":"19369195","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

site_id	SWS_FT_FI2
Number of Residues	24
Details	Modified residue: {"description":"N6-acetyllysine","evidences":[{"source":"PubMed","id":"19608861","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

site_id	SWS_FT_FI3
Number of Residues	8
Details	Modified residue: {"description":"N6-benzoyllysine; alternate","evidences":[{"source":"PubMed","id":"39524354","evidenceCode":"ECO:0000269"}]}

Chain

Residue

Details

site_id	SWS_FT_FI4
Number of Residues	1
Details	Modified residue: {"description":"Phosphoserine","evidences":[{"source":"PubMed","id":"18669648","evidenceCode":"ECO:0007744"},{"source":"PubMed","id":"19369195","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

		Sequence (fasta)
		PDBx/mmCIF
		PDBML format (no-atom)
		PDB format (full)
		Validation report (PDF)
		EDMap 2fo-fc (MTZ)