2HK7

crystal structure of shikimate dehydrogenase from aquifex aeolicus in complex with mercury at 2.5 angstrom resolution

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 112
  • Norm. En. per Res.: -2.9874
• 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	-18.5983	-2.4132	-313.578	-334.5895	112	14	24	15373	1	24	20

Interface residues

• A-B: ALA27A, ALA27B, ALA36A, ALA36B, ALA40A, ALA40B, ALA4A, ALA4B, ALA51A, ALA51B, ALA57A, ALA57B, ARG30B, ASN26A, ASN26B, ASN35A, ASN35B, ASN3A, ASN3B, ASN44A, ASN44B, ASP266B, GLN25A, GLN25B, GLN5A, GLN5B, GLN7A, GLN7B, GLU42A, GLU42B, GLU47A, GLU47B, GLU53A, GLU53B, GLY10A, GLY10B, GLY13B, GLY54A, GLY54B, GLY98A, HIS18A, HIS18B, ILE12A, ILE12B, ILE29A, ILE29B, ILE2A, ILE2B, ILE43A, ILE43B, ILE63A, ILE63B, LEU20A, LEU20B, LEU267B, LEU39A, LEU39B, LEU48A, LEU48B, LEU58A, LEU58B, LEU8A, LEU8B, LYS17A, LYS17B, LYS49A, LYS49B, LYS50A, LYS50B, LYS56A, LYS56B, LYS59A, LYS59B, LYS61A, LYS61B, MET1A, MET1B, PHE14A, PHE14B, PHE24A, PHE24B, PHE41A, PHE41B, PHE52A, PHE52B, PHE55A, PHE55B, PRO15B, PRO22A, PRO22B, PRO45A, PRO45B, SER19A, SER19B, SER21A, SER21B, THR6A, THR6B, TYR38A, TYR38B, TYR9A, TYR9B, VAL11A, VAL11B, VAL16A, VAL16B, VAL23A, VAL23B, VAL37A, VAL37B, VAL60A, VAL60B