1Q08

crystal structure of the zn(ii) form of e. coli zntr, a zinc-sensing transcriptional regulator, at 1.9 a resolution (space group p212121)

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 168
  • Norm. En. per Res.: -5.7063
• 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	-111.1601	-67.9964	-779.504	-958.6606	168	32	26	30226	4	48	28

Interface residues

• A-B: ALA113A, ALA113B, ALA118A, ALA118B, ALA129A, ALA129B, ALA134A, ALA54A, ALA54B, ALA95A, ALA95B, ALA98A, ALA98B, ARG105A, ARG105B, ARG109A, ARG109B, ARG47A, ARG47B, ARG52A, ARG52B, ARG55A, ARG55B, ARG71A, ARG71B, ARG89A, ARG89B, ARG96A, ARG96B, ASN111A, ASN111B, ASP112A, ASP112B, ASP73A, ASP73B, CYS114A, CYS114B, CYS115A, CYS115B, CYS124A, CYS124B, CYS79A, CYS79B, GLN101A, GLN101B, GLN104A, GLN104B, GLN108A, GLN108B, GLN132A, GLN132B, GLN46A, GLN46B, GLN56A, GLN56B, GLN80A, GLN80B, GLN87A, GLN87B, GLN91A, GLN91B, GLU128A, GLU128B, GLU131A, GLU131B, GLU66A, GLU66B, GLU75A, GLU75B, GLU81A, GLU81B, GLU88A, GLU88B, GLU92A, GLU92B, GLU94A, GLU94B, GLU99A, GLU99B, GLY116A, GLY116B, GLY133A, GLY133B, GLY136A, GLY58A, GLY58B, GLY84A, GLY84B, HIS119A, HIS119B, HIS53A, HIS53B, HIS76A, HIS76B, HIS77A, HIS77B, ILE126A, ILE126B, ILE51A, ILE51B, ILE64A, ILE64B, ILE70A, ILE70B, ILE72A, ILE72B, ILE85A, ILE85B, ILE97A, ILE97B, LEU100A, LEU100B, LEU107A, LEU107B, LEU110A, LEU110B, LEU127A, LEU127B, LEU130A, LEU130B, LEU57A, LEU57B, LEU67A, LEU67B, LEU68A, LEU68B, LEU90A, LEU90B, LYS49A, LYS49B, LYS83A, LYS83B, MET103A, MET103B, PHE50A, PHE50B, PHE59A, PHE59B, PRO74A, PRO74B, SER102A, SER102B, SER106A, SER106B, SER120A, SER120B, SER121A, SER121B, SER125A, SER125B, SER135A, SER43A, SER69A, SER69B, SER82A, SER82B, THR117A, THR117B, THR78A, THR78B, TYR123A, TYR123B, VAL122A, VAL122B, VAL86A, VAL86B, VAL93A, VAL93B