3MXQ

crystal structure of sensory box sensor histidine kinase from vibrio cholerae

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 118
  • Norm. En. per Res.: -3.6859
• Hub Node: A(3)

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	-69.3234	-46.7204	-261.464	-377.5077	118	12	7	12052	5	22	28
A-C	0.0	0.0	-0.1844	-0.1844	11	0	0	43	0	0	1
A-D	0.0	0.0	-93.718	-93.718	52	0	9	4732	0	6	2
B-C	0.0	0.0	-88.9442	-88.9442	53	0	9	4551	0	5	4
B-D	0.0	0.0	-18.8772	-18.8772	16	0	0	1324	0	0	1
C-D	-78.1919	-67.6039	-289.136	-434.9318	118	10	7	12648	6	21	30

Interface residues

• A-B: ALA0A, ALA0B, ALA18A, ALA18B, ALA2A, ALA2B, ALA69A, ALA69B, ARG38A, ARG38B, ARG5A, ARG5B, ASN-1A, ASN-1B, ASN-7B, ASN32A, ASN32B, ASP115A, ASP127B, ASP13A, ASP13B, CYS122A, CYS122B, CYS124A, CYS124B, CYS20A, CYS20B, GLN-3A, GLN-3B, GLN14A, GLN14B, GLU-8B, GLU107A, GLU107B, GLU10A, GLU10B, GLU114A, GLU114B, GLU33A, GLU33B, GLU73A, GLU73B, GLY116A, GLY116B, HIS112A, HIS112B, HIS120A, HIS120B, ILE109A, ILE109B, ILE111A, ILE111B, ILE118A, ILE118B, ILE21A, ILE21B, LEU-6B, LEU11A, LEU11B, LEU123A, LEU123B, LEU12A, LEU12B, LEU15A, LEU15B, LEU19A, LEU19B, LEU6A, LEU6B, LEU70B, LEU7A, LEU7B, LEU8A, LEU8B, LYS30A, LYS30B, LYS3A, LYS3B, PHE-4A, PHE-4B, PHE17A, PHE17B, PHE35A, PHE35B, PHE77A, PHE77B, PHE89A, PRO110A, PRO110B, SER-2A, SER-2B, SER113A, SER113B, SER16A, SER16B, SER37A, SER37B, SER4A, SER4B, SER74A, SER74B, SER75A, SER75B, SER76A, SER9A, SER9B, TYR-5B, TYR126A, TYR126B, TYR34A, TYR34B, VAL108A, VAL108B, VAL121A, VAL121B, VAL29B, VAL31A, VAL31B
• A-C: GLU107A, GLU107C, LEU15A, LEU15C, PHE17A, PHE17C, PHE77A, PHE77C, SER74A, SER75A, SER75C
• A-D: ALA0A, ALA0D, ARG5D, ASN-1D, ASN105A, ASN105D, ASP127A, ASP13A, ASP13D, GLN-3A, GLN-3D, GLN101A, GLN131A, GLN14A, GLN14D, GLU107A, GLU10A, GLU10D, ILE130A, LEU-6D, LEU106A, LEU11A, LEU11D, LEU12A, LEU12D, LEU15A, LEU15D, LEU6D, LEU7A, LEU7D, LEU8A, LEU8D, LYS3D, PHE-4D, PHE17A, PHE77A, PHE77D, SER-2D, SER16A, SER4A, SER4D, SER78A, SER79A, SER9A, SER9D, THR129A, TYR-5D, TYR103A, TYR103D, TYR126A, VAL128A, VAL128D
• B-C: ALA0B, ALA0C, ARG5B, ASN-1B, ASN-7B, ASN105C, ASP127C, ASP13B, ASP13C, GLN-3B, GLN-3C, GLN104C, GLN14B, GLN14C, GLU-8B, GLU107C, GLU10B, GLU10C, ILE130C, LEU-6B, LEU106C, LEU11B, LEU11C, LEU12B, LEU12C, LEU15B, LEU15C, LEU6B, LEU7B, LEU7C, LEU8B, LEU8C, LYS3B, LYS3C, PHE-4B, PHE17C, PHE77C, SER-2B, SER16C, SER4B, SER4C, SER78C, SER79C, SER9B, SER9C, THR129B, THR129C, TRP80C, TYR-5B, TYR103C, TYR126C, VAL128B, VAL128C
• B-D: ARG5B, ARG5D, GLN14B, GLN14D, LEU11B, LEU11D, LEU12B, LEU12D, LEU15B, LEU15D, LEU8B, LEU8D, PHE17B, PHE17D, SER4B, SER4D
• C-D: ALA0C, ALA0D, ALA18C, ALA18D, ALA2C, ALA2D, ALA69C, ALA69D, ARG38C, ARG38D, ARG5C, ARG5D, ASN-1C, ASN-1D, ASN32C, ASN32D, ASP115C, ASP127D, ASP13C, ASP13D, CYS122C, CYS122D, CYS124C, CYS124D, CYS20C, CYS20D, GLN-3C, GLN-3D, GLN14C, GLN14D, GLU107C, GLU107D, GLU10C, GLU10D, GLU114C, GLU114D, GLU33C, GLU33D, GLU36C, GLU36D, GLU73C, GLU73D, GLY116C, GLY116D, HIS112C, HIS112D, HIS120C, HIS120D, ILE109C, ILE109D, ILE111C, ILE111D, ILE118C, ILE118D, ILE21C, ILE21D, LEU-6D, LEU11C, LEU11D, LEU123C, LEU123D, LEU12C, LEU12D, LEU15C, LEU15D, LEU19C, LEU19D, LEU6C, LEU6D, LEU7C, LEU7D, LEU8C, LEU8D, LYS30C, LYS30D, LYS3C, LYS3D, LYS90C, PHE-4C, PHE-4D, PHE17C, PHE17D, PHE35C, PHE35D, PHE77C, PHE77D, PRO110C, PRO110D, SER-2C, SER-2D, SER113C, SER113D, SER16C, SER16D, SER37C, SER37D, SER4C, SER4D, SER74C, SER74D, SER75C, SER75D, SER76D, SER9C, SER9D, THR117C, TYR-5D, TYR126C, TYR126D, TYR34C, TYR34D, VAL108C, VAL108D, VAL121C, VAL121D, VAL29C, VAL31C, VAL31D