2HMQ

the structures of met and azidomet hemerythrin at 1.66 angstroms resolution

• Total interactions analyzed: 6
• Total true interactions: 3
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 86
  • Norm. En. per Res.: -5.5317
• 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	0.0	0.0	-14.8529	-14.8529	26	0	1	1014	0	6	6
A-D	-10.6201	-17.2461	-27.8191	-55.6853	28	1	0	1418	2	13	11
C-D	-67.445	-199.8736	-208.409	-475.7276	86	12	0	9109	17	50	43

Interface residues

• A-B: ARG110A, ARG110B, ARG15A, ARG15B, ASP23A, GLY111A, GLY111B, ILE113A, ILE113B, ILE20A, ILE20B, LEU61A, LEU61B, LYS112A, LYS112B, PHE17A, PHE17B, SER65A, SER65B, THR16A, THR16B, THR19A, THR19B, TYR109B, TYR18A, TYR18B
• A-D: ALA68A, ALA71A, ALA76A, ALA94D, ASN100A, ASN96D, ASP88D, ASP90D, GLU72A, GLY1A, GLY1D, GLY69A, GLY89D, HIS73A, ILE105A, ILE4D, LYS103A, LYS108A, LYS112A, LYS83D, LYS95D, PHE2A, THR104A, THR86D, THR92D, TRP87D, TYR93D, VAL91D
• C-D: ALA38C, ALA38D, ALA41C, ALA41D, ARG15C, ARG15D, ARG49C, ARG49D, ASN30C, ASN30D, ASN40C, ASN40D, ASN45C, ASN45D, ASP11C, ASP11D, ASP22C, ASP22D, ASP23C, ASP23D, ASP42C, ASP42D, ASP6C, ASP6D, CYS50C, CYS50D, CYS9C, CYS9D, GLN37C, GLN37D, GLU24C, GLU24D, GLU46C, GLU46D, GLY31C, GLY31D, HIS25C, HIS25D, HIS43C, HIS43D, HIS54C, HIS54D, ILE12C, ILE12D, ILE20C, ILE20D, ILE21C, ILE21D, LEU28C, LEU28D, LEU33C, LEU33D, LEU34C, LEU34D, LEU44C, LEU44D, LEU47C, LEU47D, LYS26C, LYS26D, LYS53C, LYS53D, PHE14C, PHE14D, PHE17C, PHE17D, PHE29C, PHE29D, PRO5C, PRO5D, PRO7C, PRO7D, SER13C, SER13D, SER36C, SER36D, THR19C, THR19D, THR27C, THR27D, TRP10C, TRP10D, TYR18C, TYR18D, TYR8C, TYR8D