3OKF

2.5 angstrom resolution crystal structure of 3-dehydroquinate synthase (arob) from vibrio cholerae

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 112
  • Norm. En. per Res.: -3.4258
• 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	-78.9457	21.512	-326.252	-383.6857	112	10	7	12203	0	19	27

Interface residues

• A-B: ALA118A, ALA118B, ALA119A, ALA120A, ALA120B, ALA148A, ALA148B, ALA160A, ALA160B, ALA245A, ALA245B, ARG124A, ARG124B, ARG16A, ARG16B, ARG244A, ARG244B, ARG99A, ARG99B, ASN150A, ASN150B, ASN156A, ASN156B, ASN248B, ASN86A, ASN86B, ASN96A, ASN96B, ASP113A, ASP113B, ASP237B, CYS121A, CYS121B, GLN123A, GLN123B, GLU15A, GLU15B, GLU238A, GLU238B, GLU83A, GLU83B, GLU94A, GLU94B, GLY125A, GLY125B, GLY144A, GLY144B, GLY145A, GLY145B, GLY154A, GLY154B, GLY159A, GLY159B, GLY242A, HIS151A, HIS151B, HIS95A, HIS95B, ILE158A, ILE158B, LEU153A, LEU153B, LEU82A, LEU82B, LEU92A, LEU92B, LEU93A, LEU93B, LYS146A, LYS146B, LYS155A, LYS155B, LYS328A, LYS80A, LYS80B, MET157A, MET157B, MET89A, MET89B, PHE117A, PHE117B, PHE161A, PHE161B, PHE85A, PHE85B, PHE91A, PHE91B, PRO152A, PRO152B, SER241B, SER90A, SER90B, SER98A, SER98B, THR147A, THR147B, THR81B, THR84A, THR84B, THR87A, THR87B, TYR122A, TYR122B, TYR162A, TYR162B, TYR97A, TYR97B, VAL126A, VAL149A, VAL149B, VAL88A, VAL88B