3H86

crystal structure of adenylate kinase from methanococcus maripaludis

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 88
  • Norm. En. per Res.: -3.4574
• 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
B-A	-37.4768	-17.8788	-216.198	-271.5536	86	5	7	9252	0	17	22
B-C	-56.063	-9.5498	-228.253	-293.8659	86	13	5	9500	1	19	19
A-C	-72.446	-14.4691	-217.339	-304.2541	88	12	6	9391	1	19	20
A-G	0.0	-7.1503	-77.6311	-84.7814	47	4	0	3933	0	23	27
C-G	0.0	0.0	-5.1672	-5.1672	9	0	0	342	0	4	3

Interface residues

• B-A: ALA107A, ALA107B, ALA146B, ALA157A, ALA157B, ALA158A, ALA158B, ALA159A, ALA159B, ALA168A, ARG156A, ARG156B, ARG192A, ASN114A, ASN155A, ASN155B, ASP116A, GLN152A, GLN152B, GLN67B, GLN71B, GLU122A, GLU149A, GLU149B, GLU150B, GLU186A, GLU65B, GLY100B, GLY104B, GLY163A, GLY163B, GLY167A, HIS151B, ILE117A, ILE119A, ILE172A, LEU102B, LEU105B, LEU110B, LEU165A, LEU165B, LEU191A, LYS171A, LYS174A, LYS2A, LYS4A, LYS68B, LYS96B, LYS99B, MET154A, MET154B, MET160A, MET160B, MET188A, PHE153A, PHE153B, PRO103B, PRO106B, PRO115A, PRO64B, PRO98B, SER147B, SER161A, SER161B, SER189A, SER93B, THR166A, THR169A, THR66B, THR94B, THR97B, TRP108B, TYR101B, TYR162A, TYR162B, TYR34A, VAL109B, VAL118A, VAL120A, VAL164A, VAL164B, VAL170A, VAL173A, VAL190A, VAL6A, VAL95B
• B-C: ALA107B, ALA107C, ALA146C, ALA157B, ALA157C, ALA158B, ALA158C, ALA159B, ALA159C, ALA168B, ARG156B, ARG156C, ARG192B, ASN114B, ASN155B, ASN155C, ASP116B, ASP63C, GLN152B, GLN152C, GLN67C, GLN71C, GLU122B, GLU149C, GLU150C, GLU186B, GLU65C, GLY100C, GLY104C, GLY163B, GLY163C, GLY167B, HIS151C, ILE117B, ILE119B, ILE172B, LEU102C, LEU105C, LEU110C, LEU165B, LEU165C, LEU187B, LEU191B, LYS171B, LYS174B, LYS4B, LYS68C, LYS96C, LYS99C, MET154B, MET154C, MET160B, MET160C, MET188B, PHE153B, PHE153C, PRO103C, PRO106C, PRO115B, PRO64C, PRO98C, SER147C, SER161B, SER161C, SER189B, SER93C, THR111B, THR166B, THR166C, THR169B, THR94C, THR97C, TRP108C, TYR101C, TYR162B, TYR162C, VAL109C, VAL118B, VAL120B, VAL164B, VAL164C, VAL170B, VAL173B, VAL190B, VAL6B, VAL95C
• A-C: ALA107A, ALA107C, ALA146A, ALA157A, ALA157C, ALA158A, ALA158C, ALA159A, ALA159C, ALA168C, ARG156A, ARG156C, ARG192C, ASN114C, ASN155A, ASN155C, ASN3C, ASP116C, ASP63A, GLN152C, GLN67A, GLN71A, GLU122C, GLU149A, GLU149C, GLU150A, GLU186C, GLU65A, GLY100A, GLY104A, GLY163A, GLY163C, GLY167C, HIS151A, ILE117C, ILE119C, ILE172C, LEU102A, LEU105A, LEU110A, LEU165A, LEU165C, LEU187C, LEU191C, LYS171C, LYS174C, LYS2C, LYS4C, LYS68A, LYS96A, LYS99A, MET154A, MET154C, MET160A, MET160C, MET188C, PHE153A, PHE153C, PRO103A, PRO106A, PRO115C, PRO64A, PRO98A, SER147A, SER161A, SER161C, SER189C, SER93A, THR166A, THR166C, THR169C, THR94A, THR97A, TRP108A, TYR101A, TYR162A, TYR162C, TYR34C, VAL109A, VAL118C, VAL120C, VAL164A, VAL164C, VAL170C, VAL173C, VAL190C, VAL6C, VAL95A
• A-G: ALA107A, ALA47A, ALA74A, ALA79A, ALA82G, ARG192G, ARG69A, ARG76A, ASN33G, ASN3G, ASP116G, ASP45A, GLU29G, GLU30G, GLU49A, GLU50A, GLU65A, GLU80A, GLU84G, GLY31G, GLY75A, ILE70A, ILE78A, LEU191G, LEU27G, LEU32G, LEU52A, LYS2G, LYS4G, LYS68A, LYS72A, LYS77A, LYS83A, LYS83G, MET73A, MET81A, PRO106A, PRO86G, SER189G, SER28G, SER85G, TRP108A, TYR34G, VAL109A, VAL190G, VAL46A, VAL87G
• C-G: ASN114C, ASN114G, GLY167C, LEU113G, LYS2C, LYS2G, THR111G, THR166C, THR166G