3HCG

structure of the c-terminal domain (msrb) of neisseria meningitidis pilb (reduced form)

• Total interactions analyzed: 6
• Total true interactions: 4
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 53
  • Norm. En. per Res.: -4.906
• 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	-43.5631	-64.1617	-152.293	-260.0177	53	11	0	5763	3	23	27
A-C	-5.3259	0.0	-183.947	-189.2729	71	9	2	5777	0	9	11
B-D	-6.441	0.0	-203.169	-209.61	73	4	2	6231	0	9	12
C-D	-61.0105	-34.2138	-161.976	-257.2002	53	8	0	5641	2	25	27

Interface residues

• A-B: ALA384A, ALA384B, ALA402A, ALA402B, ALA406B, ALA499A, ALA499B, ARG388A, ARG388B, ASN400A, ASN400B, ASP383A, ASP383B, GLN394A, GLN394B, GLN396A, GLN396B, GLN399A, GLN399B, GLU385A, GLU385B, GLU392A, GLU392B, GLU393A, GLU393B, GLU404A, GLU404B, GLU410A, GLU410B, HIS409A, HIS409B, LEU386A, LEU386B, LEU390A, LEU390B, LYS387A, LYS387B, PHE407B, SER382B, SER408A, SER408B, THR389A, THR389B, THR391A, THR391B, THR403A, THR403B, TYR395A, TYR395B, TYR405A, TYR405B, VAL397A, VAL397B
• A-C: ALA402A, ALA402C, ALA406A, ALA406C, ALA499A, ARG465C, ARG466A, ARG466C, ARG493A, ARG493C, ASN463A, ASN463C, ASN497A, ASN497C, ASP458C, ASP459A, ASP459C, CYS440A, CYS440C, CYS495A, CYS495C, GLU404A, GLU404C, GLU468A, GLU468C, GLY439A, GLY439C, GLY441A, GLY441C, GLY479A, GLY479C, GLY498A, HIS477A, HIS477C, HIS480A, HIS480C, ILE496A, ILE496C, LEU478A, LEU478C, PHE407A, PHE407C, PHE460A, PHE460C, PHE482A, PHE482C, PRO443A, PRO443C, SER401A, SER401C, SER444A, SER461A, SER461C, SER500A, THR403A, THR403C, THR467A, THR467C, TRP442A, TRP442C, TYR405A, TYR405C, TYR462A, TYR462C, TYR494A, VAL397A, VAL397C, VAL469A, VAL469C, VAL481A, VAL481C
• B-D: ALA402B, ALA402D, ALA406B, ALA406D, ALA499D, ARG465B, ARG466B, ARG466D, ARG493B, ARG493D, ASN463B, ASN463D, ASN497B, ASN497D, ASP458B, ASP459B, ASP459D, CYS440B, CYS440D, CYS495B, CYS495D, GLU404B, GLU404D, GLU468B, GLU468D, GLY439B, GLY441B, GLY441D, GLY479B, GLY479D, GLY498B, GLY498D, HIS457B, HIS477B, HIS477D, HIS480B, HIS480D, ILE496B, ILE496D, LEU478B, LEU478D, PHE407B, PHE407D, PHE460B, PHE460D, PHE482B, PHE482D, PRO443B, PRO443D, SER401B, SER401D, SER438B, SER444B, SER461B, SER461D, THR403B, THR403D, THR467B, THR467D, TRP442B, TRP442D, TYR405B, TYR405D, TYR462B, TYR462D, TYR494B, TYR494D, VAL397B, VAL397D, VAL469B, VAL469D, VAL481B, VAL481D
• C-D: ALA384C, ALA384D, ALA402C, ALA402D, ALA406D, ALA499C, ALA499D, ARG388C, ARG388D, ASN400C, ASN400D, ASP383C, ASP383D, GLN394C, GLN394D, GLN396C, GLN396D, GLN399C, GLN399D, GLU385C, GLU385D, GLU392C, GLU392D, GLU393C, GLU393D, GLU404C, GLU404D, GLU410C, GLU410D, HIS409C, HIS409D, LEU386C, LEU386D, LEU390C, LEU390D, LYS387C, LYS387D, PHE407C, PHE407D, SER408C, SER408D, THR389C, THR389D, THR391C, THR391D, THR403C, THR403D, TYR395C, TYR395D, TYR405C, TYR405D, VAL397C, VAL397D