2IS5

crystal structure of 3 residues truncated version of protein nmb1012 from neisseria meningitides

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 78
  • Norm. En. per Res.: -2.7814
• Hub Node: A(2)

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	-26.1588	-5.6086	-186.977	-218.7444	81	5	15	9215	1	13	16
A-D	0.0	12.7839	-91.9052	-79.1213	65	6	1	3917	0	28	27
B-C	0.0	31.4017	-94.7814	-63.3797	67	9	1	4052	0	28	27
B-D	0.0	0.0	-0.0652	-0.0652	6	0	0	33	0	4	1
C-D	-30.3059	-6.1272	-180.516	-216.9491	78	8	16	8956	0	17	16

Interface residues

• A-B: ALA100A, ALA100B, ALA101A, ALA131A, ALA131B, ALA155A, ALA155B, ALA161A, ALA161B, ALA163A, ARG128A, ARG128B, ARG133A, ARG133B, ARG152A, ARG152B, ARG153A, ARG153B, ARG99A, ARG99B, ASN123B, ASN130A, ASN130B, ASN157A, ASN157B, ASP124A, ASP124B, GLN156A, GLN156B, GLU122B, GLU132A, GLU132B, GLY102A, GLY102B, GLY141A, GLY147A, GLY147B, GLY149A, GLY149B, HIS160A, HIS160B, ILE159A, ILE159B, LEU120B, LEU125B, LEU126B, LEU127A, LEU127B, LEU134A, LEU134B, LEU140A, LEU140B, LEU158A, LEU158B, LYS139A, LYS139B, LYS148B, PHE129A, PHE129B, PHE136A, PHE136B, PHE143A, PHE146A, PRO121B, SER145A, SER162A, SER162B, THR138A, THR138B, THR142A, THR144A, TRP150A, TRP150B, TYR137A, TYR137B, VAL135A, VAL135B, VAL151A, VAL151B, VAL154A, VAL154B
• A-D: ALA39A, ALA41A, ALA41D, ALA93A, ALA93D, ALA94A, ALA94D, ARG37A, ARG37D, ARG67A, ARG67D, ARG95A, ARG95D, ARG99A, ARG99D, ASN42A, ASN42D, ASN45A, ASN45D, ASN92A, ASN92D, ASP105A, ASP105D, ASP106A, ASP106D, GLN40A, GLN40D, GLN98A, GLN98D, GLY107A, GLY107D, GLY141A, GLY43A, GLY43D, GLY89A, GLY89D, GLY91A, GLY91D, HIS88A, HIS88D, LEU140A, LEU140D, LYS139A, LYS139D, LYS62A, LYS62D, PHE136A, PHE136D, PRO104A, PRO104D, THR138A, THR38A, THR38D, TYR137A, TYR137D, TYR68D, TYR90A, TYR90D, VAL103A, VAL103D, VAL108A, VAL108D, VAL112A, VAL112D, VAL135A
• B-C: ALA41B, ALA41C, ALA93B, ALA93C, ALA94B, ALA94C, ARG37B, ARG37C, ARG67B, ARG67C, ARG69B, ARG95B, ARG95C, ARG99B, ARG99C, ASN42B, ASN42C, ASN45B, ASN92B, ASN92C, ASP105B, ASP105C, ASP106B, ASP106C, GLN40B, GLN40C, GLN98B, GLN98C, GLU66B, GLY107B, GLY107C, GLY110B, GLY141C, GLY43B, GLY43C, GLY89B, GLY89C, GLY91B, GLY91C, HIS88B, HIS88C, ILE109B, LEU140B, LEU140C, LYS139B, LYS139C, LYS62B, PHE136B, PHE136C, PRO104B, PRO104C, THR138C, THR38B, THR38C, TYR137B, TYR137C, TYR68B, TYR68C, TYR90B, TYR90C, VAL103B, VAL103C, VAL108B, VAL108C, VAL112B, VAL112C, VAL135C
• B-D: ARG128B, ARG128D, GLY102B, GLY102D, PRO104B, PRO104D
• C-D: ALA100C, ALA100D, ALA131C, ALA131D, ALA155C, ALA155D, ALA161C, ALA161D, ALA163D, ARG128C, ARG128D, ARG133C, ARG133D, ARG152C, ARG152D, ARG153C, ARG153D, ARG99C, ARG99D, ASN123C, ASN123D, ASN130C, ASN130D, ASN157C, ASN157D, ASP124C, ASP124D, ASP164D, GLN156C, GLN156D, GLU132C, GLU132D, GLY102C, GLY102D, GLY141C, GLY147C, GLY149C, GLY149D, HIS160C, HIS160D, ILE159C, ILE159D, LEU120D, LEU125D, LEU126C, LEU126D, LEU127C, LEU127D, LEU134C, LEU134D, LEU140C, LEU140D, LEU158C, LEU158D, LYS139C, LYS139D, LYS148C, PHE129C, PHE129D, PHE136C, PHE136D, PHE143C, PRO121D, SER162C, SER162D, THR138C, THR138D, THR142C, TRP150C, TRP150D, TYR137C, TYR137D, VAL135C, VAL135D, VAL151C, VAL151D, VAL154C, VAL154D