3RMX

crystal structure of hcr/d f1240a mutant

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 66
  • Norm. En. per Res.: -2.167
• 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	-7.3118	-10.772	-124.935	-143.0187	66	4	1	5287	1	10	6
A-D	-34.5654	-13.5918	-155.216	-203.3732	104	11	1	7614	2	32	30
B-C	-8.944	-12.5518	-132.418	-153.9139	93	7	0	6341	1	27	24
B-D	0.0	12.592	-5.0969	7.495	10	3	0	196	0	4	4
C-D	-2.7977	-15.108	-106.186	-124.0917	65	6	1	5003	1	11	6

Interface residues

• A-B: ALA887B, ARG1170A, ARG1225A, ASN1154A, ASN1186A, ASN1199A, ASN1227A, ASN1253A, ASN862B, ASN865B, ASN874B, ASN886B, ASN919B, ASN920B, ASN921B, ASP1142A, ASP1153A, ASP866B, ASP881B, CYS1183A, CYS1187A, GLN1185A, GLN1194A, GLN873B, GLU1226A, GLU1255A, GLY1152A, GLY1198A, GLY1201A, GLY1203A, GLY884B, ILE1155A, ILE1156A, ILE1202A, ILE1204A, ILE1207A, ILE869B, LEU918B, LYS1039B, LYS1143A, LYS1208A, LYS868B, LYS875B, LYS876B, MET1167A, PHE1205A, PHE1221A, PHE1224A, SER1064B, SER1139A, SER1141A, SER1184A, SER1206A, SER1222A, SER1223A, SER863B, SER867B, SER871B, SER883B, THR1252A, THR882B, TYR1200A, TYR1254A, TYR885B, VAL1140A, VAL880B
• A-D: ALA1232A, ALA1245A, ARG1082A, ARG1109A, ARG1126A, ARG1164D, ARG1270D, ASN1052D, ASN1073A, ASN1103A, ASN1105A, ASN1144D, ASN1162D, ASN1186A, ASN1196D, ASN1199D, ASN1214A, ASN1244A, ASN1253A, ASN898D, ASP1050D, ASP1096D, ASP1104A, ASP1108A, ASP1233A, ASP1271D, CYS1183A, CYS1187A, GLN1122A, GLN1185A, GLN896D, GLU1022A, GLU1051D, GLU1070A, GLU1077A, GLU1098D, GLU1255A, GLU1276D, GLY1198D, GLY1273D, HIS1158D, HIS995A, ILE1102A, ILE1107A, ILE1175A, ILE1234A, ILE900D, LEU1120A, LEU1160D, LEU1197D, LEU1231A, LEU1258A, LEU1259A, LYS1024A, LYS1094D, LYS1128D, LYS1138D, LYS1143D, LYS1165D, LYS1213A, LYS1215A, LYS1236A, LYS1257A, MET1054D, MET1159D, MET1229A, PHE1095D, PHE1242A, PHE1264A, PRO1134D, PRO1145D, PRO1272D, SER1147D, SER1163D, SER1195D, SER1212A, SER1260A, SER1262A, SER1263A, SER1269D, THR1097D, THR1136D, THR1252A, THR1256A, THR1261A, THR899D, TRP1274D, TYR1100D, TYR1106A, TYR1123A, TYR1130D, TYR1146D, TYR1161D, TYR1166D, TYR1176A, TYR1200D, TYR1235A, TYR1246A, TYR1254A, VAL1188A, VAL1211A, VAL1249A, VAL1251A, VAL1275D
• B-C: ALA1232C, ALA1245C, ARG1109C, ARG1126C, ARG1164B, ARG1270B, ASN1091B, ASN1103C, ASN1105C, ASN1144B, ASN1162B, ASN1186C, ASN1214C, ASN1244C, ASN1253C, ASN898B, ASP1096B, ASP1104C, ASP1108C, ASP1125B, ASP1233C, ASP1271B, CYS1187C, GLN1122C, GLN1185C, GLN896B, GLU1022C, GLU1051B, GLU1098B, GLU1255C, GLU1276B, GLY1198B, GLY1273B, HIS1158B, ILE1102C, ILE1107C, ILE1234C, ILE900B, LEU1023C, LEU1120C, LEU1160B, LEU1197B, LEU1231C, LEU1258C, LEU1259C, LYS1024C, LYS1094B, LYS1128B, LYS1138B, LYS1165B, LYS1213C, LYS1236C, LYS1257C, LYS906B, MET1229C, PHE1095B, PHE1264C, PRO1124B, PRO1134B, PRO1145B, PRO1272B, SER1147B, SER1163B, SER1195B, SER1212C, SER1260C, SER1262C, SER1263C, SER1269B, THR1097B, THR1136B, THR1252C, THR1256C, THR1261C, THR899B, THR996C, TRP1274B, TYR1100B, TYR1106C, TYR1123C, TYR1130B, TYR1146B, TYR1161B, TYR1166B, TYR1176C, TYR1235C, TYR1246C, TYR1254C, VAL1188C, VAL1211C, VAL1249C, VAL1251C, VAL1275B
• B-D: ALA878B, ASN877B, ASN877D, ASP893B, ASP893D, GLY892B, LYS876B, LYS876D, VAL891B, VAL891D
• C-D: ALA887D, ARG1170C, ARG1225C, ASN1154C, ASN1196C, ASN1199C, ASN1227C, ASN1253C, ASN862D, ASN865D, ASN886D, ASN919D, ASN920D, ASN921D, ASP1142C, ASP1153C, ASP866D, ASP881D, CYS1183C, GLN1185C, GLN1194C, GLN873D, GLU1226C, GLY1152C, GLY1198C, GLY1201C, GLY1203C, GLY884D, ILE1155C, ILE1156C, ILE1202C, ILE1204C, ILE1207C, ILE869D, ILE922D, LYS1065D, LYS1143C, LYS1208C, LYS868D, LYS875D, LYS876D, PHE1205C, PHE1221C, PHE1224C, SER1064D, SER1139C, SER1141C, SER1184C, SER1206C, SER1222C, SER1223C, SER863D, SER867D, SER871D, SER883D, THR1172C, THR1228C, THR1252C, THR882D, TYR1189C, TYR1200C, TYR1254C, TYR885D, VAL1140C, VAL880D