1BCJ

mannose-binding protein-a mutant (qpdwghv) complexed with n- acetyl-d-galactosamine

• Total interactions analyzed: 3
• Total true interactions: 3
• Strongest Interaction:
  • Chains: 1-2
  • Int. Res.: 93
  • Norm. En. per Res.: -3.6686
• Hub Node: 1(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
1-2	-30.8951	-32.7817	-277.5	-341.1768	93	17	9	11379	3	30	41
1-3	-29.5675	-25.2676	-242.577	-297.412	87	15	11	10537	2	27	38
2-3	-15.2039	-25.6208	-259.078	-299.9027	91	16	10	10697	1	30	42

Interface residues

• 1-2: ALA1001, ALA1002, ALA1262, ALA2202, ALA731, ALA732, ALA791, ALA792, ALA831, ALA832, ARG1182, ARG1322, ASN1152, ASN801, ASN802, ASN861, ASN862, ASN961, ASN962, CYS1282, CYS2222, GLU1172, GLU1302, GLU2232, GLU751, GLU752, GLU821, GLU822, GLU841, GLU842, GLU931, GLU932, GLY1041, GLY1081, GLY1332, HIS1162, HIS91, HIS991, HIS992, ILE741, ILE742, ILE851, ILE852, LEU1272, LEU1312, LEU781, LEU782, LEU881, LEU882, LEU921, LEU922, LEU941, LEU981, LYS1051, LYS1061, LYS1091, LYS1232, LYS771, LYS772, LYS891, LYS892, LYS911, LYS912, LYS971, LYS972, MET1031, MET1032, MET1192, MET811, MET812, PHE1011, PHE1111, PHE1112, PHE1122, PHE2242, SER1021, SER1022, SER1071, SER1292, SER901, SER902, THR1142, THR2192, THR871, THR872, THR951, THR952, VAL1132, VAL1242, VAL1502, VAL2212, VAL761, VAL762
• 1-3: ALA1001, ALA1003, ALA2201, ALA733, ALA791, ALA793, ALA831, ALA833, ARG1181, ARG1321, ASN1151, ASN801, ASN803, ASN861, ASN863, ASN961, ASN963, CYS1281, CYS2221, GLU1171, GLU1301, GLU2231, GLU751, GLU753, GLU821, GLU823, GLU841, GLU843, GLU931, GLU933, GLY1043, GLY1083, GLY1331, HIS1161, HIS991, HIS993, ILE741, ILE743, ILE851, ILE853, LEU1271, LEU1311, LEU781, LEU783, LEU881, LEU883, LEU921, LEU923, LEU943, LEU983, LYS1053, LYS1063, LYS1093, LYS1231, LYS771, LYS773, LYS891, LYS893, LYS913, LYS973, MET1031, MET1033, MET1191, MET811, MET813, PHE1013, PHE1111, PHE1121, PHE2241, SER1021, SER1023, SER1073, SER1291, SER901, SER903, THR1141, THR2191, THR871, THR873, THR951, THR953, VAL1131, VAL1241, VAL1501, VAL2211, VAL761, VAL763
• 2-3: ALA1002, ALA1003, ALA2203, ALA732, ALA792, ALA793, ALA832, ALA833, ARG1183, ARG1323, ASN1153, ASN802, ASN803, ASN862, ASN863, ASN962, ASN963, CYS1283, CYS2223, GLU1173, GLU1303, GLU1492, GLU2233, GLU752, GLU753, GLU822, GLU823, GLU842, GLU843, GLU932, GLU933, GLY1042, GLY1082, GLY1333, HIS1163, HIS992, HIS993, ILE742, ILE743, ILE852, ILE853, LEU1273, LEU1313, LEU782, LEU783, LEU882, LEU883, LEU922, LEU923, LEU942, LEU982, LYS1052, LYS1062, LYS1092, LYS1233, LYS1522, LYS1523, LYS772, LYS773, LYS892, LYS893, LYS912, LYS913, LYS972, MET1032, MET1033, MET1193, MET812, MET813, PHE1012, PHE1112, PHE1113, PHE1123, PHE2243, SER1022, SER1023, SER1072, SER1293, SER902, SER903, THR1143, THR2193, THR872, THR873, THR952, THR953, VAL1133, VAL1243, VAL1503, VAL2213, VAL762