2B7L

crystal structure of ctp:glycerol-3-phosphate cytidylyltransferase from staphylococcus aureus

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 64
  • Norm. En. per Res.: -4.6599
• Hub Node: A(3)

All Interactions

Chains	Hydro. Bond Ener. (kJ/mol)	Elec. Ener. (kJ/mol)	VDW. Ener. (kJ/mol)	Tot. Stab. Ener. (kJ/mol)	#int. res.	# Short cont.	#Hydr. int.	#VDW pairs	#salt bridges	#Pot. fav. elec. int	#Pot. unfav. elec. int
A-B	-56.2276	2.537	-237.115	-290.8056	65	25	3	8548	1	22	23
A-C	-10.894	-16.4086	-64.2968	-91.5994	33	2	0	1916	4	34	27
A-D	-16.3874	-27.2966	-54.0446	-97.7286	27	3	2	2248	2	16	18
B-C	-11.0242	-14.2535	-44.6581	-69.9358	27	5	2	1768	0	16	14
B-D	0.0	0.0	-10.1606	-10.1606	10	2	0	477	0	0	2
C-D	-77.781	0.8937	-221.344	-298.2313	64	27	4	8391	0	24	27

Interface residues

• A-B: ARG22A, ARG522B, ARG525B, ARG555B, ARG55A, ARG563B, ARG63A, ASP11A, ASP511B, ASP51A, ASP551B, ASP566B, ASP66A, GLN54A, GLN554B, GLU19A, GLU519B, GLU53A, GLU553B, GLU560B, GLU60A, GLY16A, GLY516B, HIS14A, HIS17A, HIS514B, HIS517B, ILE18A, ILE518B, ILE562B, ILE62A, LEU12A, LEU13A, LEU21A, LEU512B, LEU513B, LEU520B, LEU521B, LEU531B, LEU559B, LEU567B, LEU59A, LEU67A, LYS556B, LYS56A, MET557B, MET558B, MET57A, MET58A, SER561B, SER61A, TYR15A, TYR49A, TYR50A, TYR510B, TYR515B, TYR530B, TYR549B, TYR550B, TYR564B, TYR64A, VAL565B, VAL568B, VAL65A, VAL68A
• A-C: ARG1023C, ARG1113C, ARG113A, ARG23A, ASP1094C, ASP94A, GLU1096C, GLU1098C, GLU115A, GLU96A, GLY1092C, GLY92A, GLY97A, HIS1014C, HIS1017C, HIS1093C, HIS14A, HIS45A, HIS93A, LEU1012C, LEU1111C, LEU111A, LYS1112C, LYS112A, LYS44A, LYS46A, MET1091C, THR114A, TRP1095C, TRP95A, TYR1015C, TYR110A, TYR1110C
• A-D: ARG1555D, ASP11A, ASP1511D, ASP1538D, ASP1551D, ASP51A, GLN1542D, GLN1554D, GLN42A, GLN54A, GLU1539D, GLU1553D, HIS45A, LEU12A, LEU1512D, LYS1546D, LYS1547D, LYS46A, LYS47A, SER1548D, SER48A, THR1537D, TYR1549D, TYR1550D, TYR1552D, TYR49A, TYR50A
• B-C: ARG555B, ASN541B, ASP1011C, ASP1051C, ASP511B, ASP538B, ASP551B, GLN1054C, GLN542B, GLN554B, GLU539B, GLU553B, HIS1045C, LEU1012C, LEU512B, LYS1046C, LYS1047C, LYS546B, LYS547B, SER1048C, SER548B, THR537B, TYR1049C, TYR1050C, TYR549B, TYR550B, TYR552B
• B-D: ASP1511D, ASP511B, HIS1514D, HIS514B, LEU1512D, LEU512B, LYS547B, TYR1515D, TYR1549D, TYR549B
• C-D: ARG1022C, ARG1025C, ARG1055C, ARG1063C, ARG1522D, ARG1523D, ARG1555D, ARG1563D, ASP1011C, ASP1051C, ASP1066C, ASP1511D, ASP1551D, ASP1566D, GLN1054C, GLN1554D, GLU1019C, GLU1053C, GLU1060C, GLU1519D, GLU1553D, GLU1560D, GLY1016C, GLY1516D, HIS1014C, HIS1017C, HIS1514D, HIS1517D, ILE1018C, ILE1062C, ILE1518D, ILE1562D, LEU1012C, LEU1013C, LEU1020C, LEU1021C, LEU1031C, LEU1059C, LEU1067C, LEU1512D, LEU1513D, LEU1520D, LEU1521D, LEU1559D, LEU1567D, LYS1056C, LYS1556D, MET1057C, MET1058C, MET1557D, MET1558D, SER1061C, SER1561D, TYR1015C, TYR1049C, TYR1050C, TYR1064C, TYR1510D, TYR1515D, TYR1550D, TYR1564D, VAL1065C, VAL1565D, VAL1568D