3IKT

crystal structure of a rex-family repressor/dna/nad+ complex from thermus aquaticus

• Total interactions analyzed: 6
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 224
  • Norm. En. per Res.: -4.0831
• Hub Node: A(1)

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	-82.7168	-150.7038	-681.192	-914.6127	224	26	31	29351	14	39	42

Interface residues

• A-B: ALA144A, ALA144B, ALA172A, ALA172B, ALA183A, ALA183B, ALA191A, ALA191B, ALA199A, ALA199B, ALA23A, ALA23B, ALA38A, ALA38B, ALA6A, ALA6B, ALA7A, ALA7B, ALA94A, ALA94B, ALA96A, ALA96B, ARG10A, ARG10B, ARG120A, ARG123A, ARG123B, ARG150A, ARG150B, ARG16A, ARG16B, ARG195A, ARG195B, ARG206A, ARG206B, ARG72A, ARG72B, ARG79A, ARG79B, ARG90A, ARG90B, ASN170A, ASN170B, ASN186A, ASN186B, ASN202A, ASN202B, ASN78A, ASN78B, ASP188A, ASP188B, ASP97A, ASP97B, CYS84A, CYS84B, GLN154A, GLN154B, GLN24A, GLN24B, GLN39A, GLN39B, GLU106A, GLU106B, GLU142A, GLU142B, GLU151A, GLU151B, GLU177A, GLU177B, GLU181A, GLU181B, GLU185A, GLU185B, GLU19A, GLU19B, GLU20A, GLU20B, GLU36A, GLU36B, GLU5A, GLU5B, GLY100A, GLY100B, GLY102A, GLY102B, GLY167A, GLY167B, GLY192A, GLY192B, GLY35A, GLY35B, GLY76A, GLY76B, GLY82B, GLY89A, GLY89B, GLY92A, GLY92B, HIS73A, HIS73B, ILE12A, ILE12B, ILE143A, ILE143B, ILE165A, ILE165B, ILE168A, ILE168B, ILE17A, ILE17B, ILE200A, ILE200B, ILE74A, ILE74B, ILE85B, ILE8A, ILE8B, LEU107A, LEU107B, LEU11A, LEU11B, LEU145A, LEU145B, LEU146A, LEU146B, LEU15A, LEU15B, LEU169A, LEU169B, LEU176A, LEU176B, LEU190A, LEU190B, LEU193A, LEU193B, LEU196A, LEU196B, LEU201A, LEU201B, LEU21A, LEU37A, LEU37B, LEU71A, LEU71B, LEU75A, LEU75B, LEU77A, LEU77B, LEU83A, LEU83B, LEU91A, LEU91B, LEU95A, LEU95B, LYS166A, LYS166B, LYS180A, LYS180B, LYS204B, LYS2A, LYS2B, MET1A, MET1B, PHE101A, PHE101B, PHE105A, PHE105B, PHE171A, PHE171B, PHE189A, PHE189B, PHE198A, PHE198B, PHE52A, PHE52B, PRO149A, PRO149B, PRO173A, PRO173B, PRO179A, PRO203A, PRO203B, PRO4A, PRO4B, PRO99A, PRO99B, SER104A, SER104B, SER197A, SER197B, SER93A, SER93B, SER9A, SER9B, THR13A, THR13B, THR194A, THR194B, TRP205A, TRP205B, TRP81A, TRP81B, TYR14A, TYR14B, TYR51A, TYR51B, TYR98A, TYR98B, VAL174A, VAL174B, VAL175A, VAL175B, VAL178A, VAL178B, VAL182A, VAL182B, VAL184A, VAL184B, VAL187A, VAL187B, VAL3A, VAL3B, VAL40A, VAL40B