3PMC

crystal structure of the sporulation inhibitor pxo2-61 from bacillus anthracis

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 112
  • Norm. En. per Res.: -2.7613
• 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	-8.2539	-19.4813	-281.525	-309.2602	112	6	21	12072	0	21	26

Interface residues

• A-B: ALA111A, ALA111B, ALA136A, ALA136B, ALA77B, ALA82A, ALA82B, ARG30A, ARG30B, ARG32B, ARG74B, ASN103A, ASN103B, ASN117A, ASN117B, ASN80A, ASN80B, ASN87A, ASN87B, ASN89A, ASN89B, ASN97A, ASN97B, ASP105A, ASP105B, ASP121A, ASP121B, GLN107A, GLN107B, GLN108A, GLN108B, GLN110A, GLN110B, GLN118A, GLN118B, GLN134A, GLN134B, GLU133A, GLU133B, GLU83A, GLU83B, HIS122A, HIS122B, HIS129A, HIS129B, HIS86A, HIS86B, ILE116A, ILE116B, ILE124A, ILE124B, ILE28A, ILE28B, ILE75A, ILE75B, ILE81A, ILE81B, ILE85A, ILE85B, ILE93A, ILE93B, LEU101A, LEU101B, LEU102A, LEU102B, LEU106A, LEU106B, LEU112A, LEU112B, LEU123A, LEU123B, LEU99A, LEU99B, LYS114A, LYS114B, LYS135A, LYS135B, LYS78B, LYS92A, LYS92B, MET96A, MET96B, PHE120A, PHE120B, PHE84A, PHE84B, PRO104A, PRO104B, SER130A, SER130B, THR100A, THR100B, THR127A, THR127B, THR88A, THR88B, TYR109A, TYR109B, TYR125A, TYR125B, TYR126A, TYR126B, TYR131A, TYR131B, TYR132A, TYR132B, VAL113A, VAL113B, VAL128A, VAL128B, VAL79A, VAL79B