3TA0

a. fulgidus glnk3, mgatp complex

• Total interactions analyzed: 15
• Total true interactions: 9
• Strongest Interaction:
  • Chains: D-F
  • Int. Res.: 102
  • Norm. En. per Res.: -5.4462
• 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	-120.0445	-50.3088	-328.034	-498.3873	102	21	14	13624	7	39	47
A-C	-131.1862	-30.2381	-338.99	-500.4143	103	20	14	13642	7	39	43
A-E	0.0	0.0	-0.8261	-0.8261	10	0	0	80	0	7	3
B-C	-135.1587	-54.9604	-339.775	-529.8941	103	18	14	13773	9	41	47
B-D	0.0	0.0	-4.3571	-4.3571	14	0	2	430	0	5	4
B-E	-74.9209	7.6193	-100.874	-168.1756	45	8	2	3933	4	26	25
D-E	-125.61	-35.5695	-324.068	-485.2474	104	24	14	13695	7	39	48
D-F	-154.3155	-57.7988	-343.403	-555.5172	102	25	15	13617	9	38	43
E-F	-137.9712	-51.3088	-341.301	-530.581	105	15	14	13852	7	39	46

Interface residues

• A-B: ALA19B, ALA6A, ALA81A, ARG103B, ARG36A, ARG82A, ARG90A, ARG9A, ASP106B, ASP54A, ASP67A, ASP71A, ASP88A, GLN39A, GLN57A, GLU107B, GLU108B, GLU14B, GLU21B, GLU22B, GLU32A, GLU32B, GLU38A, GLU62A, GLU62B, GLU75A, GLU97A, GLU97B, GLY105B, GLY24B, GLY27B, GLY35A, GLY37A, GLY84A, GLY87A, GLY89A, ILE102B, ILE77A, ILE8A, ILE91A, ILE94A, ILE94B, LEU13B, LEU20B, LEU55A, LEU56A, LYS101B, LYS12A, LYS17B, LYS18B, LYS2A, LYS2B, LYS34A, LYS58A, LYS60A, LYS60B, LYS85A, LYS98B, MET1A, MET1B, MET28B, MET3A, MET3B, PHE25B, PHE86A, PHE92A, PRO95A, PRO95B, SER79A, SER80A, SER99B, THR104B, THR29B, THR31A, THR31B, THR59A, THR59B, THR83A, VAL100B, VAL109B, VAL16A, VAL16B, VAL26B, VAL30B, VAL33A, VAL33B, VAL4A, VAL53A, VAL5A, VAL5B, VAL61A, VAL61B, VAL63B, VAL64B, VAL65B, VAL70A, VAL74A, VAL78A, VAL7A, VAL93A, VAL96A, VAL96B
• A-C: ALA19A, ALA6C, ALA81C, ARG103A, ARG23A, ARG36C, ARG82C, ARG90C, ARG9C, ASP106A, ASP54C, ASP67C, ASP71C, ASP88C, CYS15A, GLN57C, GLU107A, GLU108A, GLU14A, GLU21A, GLU22A, GLU32A, GLU32C, GLU38C, GLU62A, GLU62C, GLU75C, GLU97A, GLU97C, GLY105A, GLY24A, GLY27A, GLY35C, GLY37C, GLY84C, GLY87C, GLY89C, ILE102A, ILE77C, ILE8C, ILE91C, ILE94A, ILE94C, LEU13A, LEU20A, LEU55C, LEU56C, LYS101A, LYS12C, LYS17A, LYS18A, LYS2A, LYS2C, LYS34C, LYS58C, LYS60A, LYS60C, LYS85C, LYS98A, MET1A, MET1C, MET28A, MET3A, MET3C, PHE25A, PHE86C, PHE92C, PRO95A, PRO95C, SER79C, SER80C, SER99A, THR104A, THR29A, THR31A, THR31C, THR59A, THR59C, THR83C, VAL100A, VAL109A, VAL16A, VAL16C, VAL26A, VAL30A, VAL33A, VAL33C, VAL4C, VAL53C, VAL5A, VAL5C, VAL61A, VAL61C, VAL63A, VAL64A, VAL65A, VAL70C, VAL74C, VAL78C, VAL7C, VAL93C, VAL96A, VAL96C
• A-E: ALA111E, ALA69E, ARG82A, ASP68E, GLU72E, GLU75A, GLY84A, PHE86A, SER66E, VAL78A
• B-C: ALA19C, ALA6B, ALA81B, ARG103C, ARG23C, ARG36B, ARG82B, ARG90B, ARG9B, ASP106C, ASP54B, ASP67B, ASP68B, ASP71B, ASP88B, GLN57B, GLU107C, GLU108C, GLU14C, GLU21C, GLU22C, GLU32B, GLU32C, GLU38B, GLU62B, GLU62C, GLU72B, GLU75B, GLU97B, GLU97C, GLY105C, GLY24C, GLY27C, GLY35B, GLY37B, GLY84B, GLY87B, GLY89B, ILE102C, ILE77B, ILE8B, ILE91B, ILE94B, ILE94C, LEU13C, LEU20C, LEU55B, LEU56B, LYS101C, LYS12B, LYS17C, LYS18C, LYS2B, LYS2C, LYS34B, LYS58B, LYS60B, LYS60C, LYS85B, LYS98C, MET1B, MET1C, MET28C, MET3B, MET3C, PHE25C, PHE86B, PHE92B, PRO95B, PRO95C, SER79B, SER80B, SER99C, THR104C, THR29C, THR31B, THR31C, THR59B, THR59C, THR83B, VAL100C, VAL109C, VAL16B, VAL16C, VAL26C, VAL30C, VAL33B, VAL33C, VAL4B, VAL5B, VAL5C, VAL61B, VAL61C, VAL63C, VAL64C, VAL65C, VAL70B, VAL74B, VAL78B, VAL7B, VAL93B, VAL96B, VAL96C
• B-D: ALA111B, ALA112B, ALA76D, ARG82D, ASP68B, ASP71D, GLU72B, GLU72D, GLU75D, GLY84D, ILE91D, PHE86D, VAL74D, VAL78D
• B-E: ALA110B, ALA110E, ALA111B, ALA111E, ALA112B, ALA112E, ALA69B, ALA69E, ARG103B, ARG103E, ASP106B, ASP106E, ASP67B, ASP67E, ASP68B, ASP68E, GLU107B, GLU107E, GLU108B, GLU108E, GLU72B, GLU97E, GLY105B, GLY105E, ILE102E, LYS101B, LYS101E, LYS2B, LYS98B, LYS98E, MET1B, MET1E, PHE25B, SER66B, SER66E, SER99B, SER99E, THR104B, THR104E, VAL100B, VAL100E, VAL109B, VAL109E, VAL65B, VAL65E
• D-E: ALA112E, ALA19E, ALA6D, ALA81D, ARG103E, ARG23E, ARG36D, ARG82D, ARG90D, ARG9D, ASP106E, ASP54D, ASP67D, ASP68D, ASP71D, ASP88D, GLN57D, GLU107E, GLU108E, GLU14E, GLU21E, GLU22E, GLU32D, GLU32E, GLU38D, GLU62D, GLU62E, GLU72D, GLU75D, GLU97D, GLU97E, GLY105E, GLY24E, GLY27E, GLY35D, GLY37D, GLY84D, GLY87D, GLY89D, ILE102E, ILE77D, ILE8D, ILE91D, ILE94D, ILE94E, LEU13E, LEU20E, LEU55D, LEU56D, LYS101E, LYS12D, LYS17E, LYS18E, LYS2D, LYS2E, LYS34D, LYS58D, LYS60D, LYS60E, LYS85D, LYS98E, MET1D, MET1E, MET28E, MET3D, MET3E, PHE25E, PHE86D, PHE92D, PRO95D, PRO95E, SER79D, SER80D, SER99E, THR104E, THR29E, THR31D, THR31E, THR59D, THR59E, THR83D, VAL100E, VAL109E, VAL16D, VAL16E, VAL26E, VAL30E, VAL33D, VAL33E, VAL4D, VAL5D, VAL5E, VAL61D, VAL61E, VAL63E, VAL64E, VAL65E, VAL70D, VAL74D, VAL78D, VAL7D, VAL93D, VAL96D, VAL96E
• D-F: ALA19D, ALA6F, ALA81F, ARG103D, ARG23D, ARG36F, ARG82F, ARG90F, ARG9F, ASP106D, ASP54F, ASP67F, ASP71F, ASP88F, GLN57F, GLU107D, GLU108D, GLU14D, GLU21D, GLU22D, GLU32D, GLU32F, GLU38F, GLU62D, GLU62F, GLU75F, GLU97D, GLU97F, GLY105D, GLY24D, GLY27D, GLY35F, GLY37F, GLY84F, GLY87F, GLY89F, ILE102D, ILE77F, ILE8F, ILE91F, ILE94D, ILE94F, LEU13D, LEU20D, LEU55F, LEU56F, LYS101D, LYS12F, LYS17D, LYS18D, LYS2D, LYS2F, LYS34F, LYS58F, LYS60D, LYS60F, LYS85F, LYS98D, MET1D, MET1F, MET28D, MET3D, MET3F, PHE25D, PHE86F, PHE92F, PRO95D, PRO95F, SER79F, SER80F, SER99D, THR104D, THR29D, THR31D, THR31F, THR59D, THR59F, THR83F, VAL100D, VAL109D, VAL16D, VAL16F, VAL26D, VAL30D, VAL33D, VAL33F, VAL4F, VAL53F, VAL5D, VAL5F, VAL61D, VAL61F, VAL63D, VAL64D, VAL65D, VAL70F, VAL74F, VAL78F, VAL7F, VAL93F, VAL96D, VAL96F
• E-F: ALA110F, ALA112E, ALA19F, ALA6E, ALA81E, ARG103F, ARG23F, ARG36E, ARG82E, ARG90E, ARG9E, ASP106F, ASP54E, ASP67E, ASP68E, ASP71E, ASP88E, GLN57E, GLU107F, GLU108F, GLU14F, GLU21F, GLU22F, GLU32E, GLU32F, GLU38E, GLU62E, GLU62F, GLU72E, GLU75E, GLU97E, GLU97F, GLY105F, GLY24F, GLY27F, GLY35E, GLY37E, GLY84E, GLY87E, GLY89E, ILE102F, ILE77E, ILE8E, ILE91E, ILE94E, ILE94F, LEU13F, LEU20F, LEU55E, LEU56E, LYS101F, LYS12E, LYS17F, LYS18F, LYS2E, LYS2F, LYS34E, LYS58E, LYS60E, LYS60F, LYS85E, LYS98F, MET1E, MET1F, MET28F, MET3E, MET3F, PHE25F, PHE86E, PHE92E, PRO95E, PRO95F, SER79E, SER80E, SER99F, THR104F, THR29F, THR31E, THR31F, THR59E, THR59F, THR83E, VAL100F, VAL109F, VAL16E, VAL16F, VAL26F, VAL30F, VAL33E, VAL33F, VAL4E, VAL5E, VAL5F, VAL61E, VAL61F, VAL63F, VAL64F, VAL65F, VAL70E, VAL74E, VAL78E, VAL7E, VAL93E, VAL96E, VAL96F