2BRU

complex of the domain i and domain iii of escherichia coli transhydrogenase

• Total interactions analyzed: 3
• Total true interactions: 3
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 218
  • Norm. En. per Res.: -3.3686
• Hub Node: A(2)

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	-109.1238	-9.7566	-615.472	-734.3524	218	41	12	24050	4	35	47
A-C	-13.4865	-21.1339	-99.6731	-134.2935	49	9	2	4517	2	6	4
B-C	-35.9921	-37.6377	-158.55	-232.1799	88	14	3	6611	2	27	14

Interface residues

• A-B: ALA1043A, ALA1043B, ALA1049A, ALA1049B, ALA1124A, ALA1124B, ALA1129A, ALA1129B, ALA1134A, ALA1134B, ALA1137A, ALA1137B, ALA1145A, ALA1145B, ALA1146A, ALA1146B, ALA1159A, ALA1159B, ALA1160A, ALA1160B, ALA1166A, ALA1166B, ALA1179A, ALA1179B, ALA1180A, ALA1180B, ALA1183A, ALA1183B, ALA1184A, ALA1184B, ALA1189A, ALA1189B, ALA1277A, ALA1277B, ARG1123B, ARG1140A, ARG1140B, ARG1151A, ARG1151B, ARG1318A, ARG1318B, ASN1135A, ASN1135B, ASN1185A, ASN1185B, ASN1305A, ASN1305B, ASN1330A, ASN1330B, ASN1333A, ASN1333B, ASP1046A, ASP1046B, ASP1047B, ASP1128A, ASP1128B, ASP1250A, ASP1250B, ASP1273A, ASP1273B, GLN1025A, GLN1025B, GLN1041A, GLN1041B, GLN1052A, GLN1125A, GLN1125B, GLN1156A, GLN1156B, GLN1322A, GLN1322B, GLN1325A, GLN1325B, GLU1144A, GLU1144B, GLU1148A, GLU1148B, GLU1304A, GLU1304B, GLY1040A, GLY1040B, GLY1138A, GLY1138B, GLY1150A, GLY1150B, GLY1155A, GLY1155B, GLY1161A, GLY1161B, GLY1182A, GLY1182B, GLY1188A, GLY1188B, GLY1278A, GLY1278B, GLY1306A, GLY1306B, GLY1317A, GLY1328A, GLY1328B, HIS1147A, HIS1147B, ILE1136A, ILE1136B, ILE1142A, ILE1142B, ILE1157A, ILE1157B, ILE1251A, ILE1251B, ILE1300A, ILE1300B, ILE1310B, LEU1042A, LEU1042B, LEU1127A, LEU1127B, LEU1178A, LEU1178B, LEU1187A, LEU1187B, LEU1315B, LEU1319A, LEU1319B, LEU1326A, LEU1326B, LEU1331A, LEU1331B, LEU1334B, LYS1021A, LYS1021B, LYS1048A, LYS1048B, LYS1162A, LYS1162B, LYS1247B, LYS1276A, LYS1276B, LYS1308A, LYS1308B, LYS1336B, MET1133A, MET1133B, MET1207A, MET1207B, MET1275A, MET1275B, PHE1045A, PHE1045B, PHE1149A, PHE1149B, PHE1152A, PHE1152B, PHE1153A, PHE1153B, PRO1020A, PRO1020B, PRO1164A, PRO1164B, PRO1165A, PRO1165B, PRO1320A, PRO1320B, SER1044A, SER1044B, SER1122A, SER1122B, SER1126A, SER1126B, SER1131A, SER1131B, SER1132A, SER1132B, SER1186A, SER1186B, SER1274B, SER1279A, SER1279B, SER1323A, SER1323B, SER1324A, SER1324B, THR1014A, THR1014B, THR1019A, THR1019B, THR1022A, THR1022B, THR1154A, THR1154B, THR1158A, THR1158B, THR1302A, THR1302B, THR1303A, THR1303B, THR1321A, THR1321B, THR1329A, THR1329B, TYR1139A, TYR1139B, TYR1312A, TYR1312B, TYR1327A, TYR1327B, VAL1143A, VAL1143B, VAL1163A, VAL1163B, VAL1175A, VAL1175B, VAL1280A, VAL1280B, VAL1307A, VAL1307B, VAL1332A, VAL1332B
• A-C: ALA1159A, ALA1160A, ALA1189A, ALA1209A, ALA84C, ASN1185A, ASN80C, ASP91C, ASP97C, GLN1156A, GLU1210A, GLU85C, GLU95C, GLY1155A, GLY1161A, GLY1188A, GLY1208A, GLY67C, GLY77C, HIS69C, HIS78C, ILE1157A, ILE1190A, ILE68C, LEU1187A, LEU75C, LEU82C, LEU83C, LEU94C, LYS1162A, LYS87C, MET133C, MET79C, MET96C, PHE1152A, PHE1153A, PRO1164A, PRO1165A, PRO134C, PRO70C, PRO76C, SER1186A, THR1154A, THR1158A, TYR90C, VAL1163A, VAL71C, VAL81C, VAL93C
• B-C: ALA1124B, ALA1173B, ALA1176B, ALA1179B, ALA1180B, ALA1183B, ALA1193B, ALA1209B, ALA122C, ALA131C, ALA42C, ALA72C, ARG1120B, ARG1123B, ARG1197B, ARG74C, ASN100C, ASN1135B, ASN1185B, ASN1330B, ASN1333B, ASP124C, ASP1352B, ASP97C, GLN1025B, GLN1125B, GLN1203B, GLN1205B, GLN123C, GLN1374B, GLU1199B, GLU1202B, GLU137C, GLU95C, GLU98C, GLY1177B, GLY1182B, GLY1208B, GLY132C, GLY73C, GLY77C, HIS69C, HIS78C, ILE1121B, ILE1181B, ILE130C, ILE1373B, LEU1127B, LEU1178B, LEU1337B, LEU75C, LEU82C, LYS1201B, LYS1336B, LYS1342B, MET1207B, MET133C, MET79C, MET96C, PRO1119B, PRO1198B, PRO126C, PRO129C, PRO134C, PRO70C, PRO76C, SER1122B, SER1126B, SER1131B, SER1186B, SER1206B, SER128C, THR1329B, TYR155C, TYR39C, VAL1170B, VAL1175B, VAL1191B, VAL1200B, VAL1204B, VAL1332B, VAL1353B, VAL1354B, VAL135C, VAL1375B, VAL43C, VAL71C, VAL81C