3MQB

crystal structure of ectodomain of bst-2/tetherin/cd317 (c2)

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: B-F
  • Int. Res.: 22
  • Norm. En. per Res.: -2.425
• 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	-7.2629	-51.6235	208.829	149.9426	176	24	34	19385	1	52	63
A-E	-4.5914	-18.2802	-30.9224	-53.794	35	3	0	1574	2	18	20
A-F	-2.2868	-35.9764	-51.7469	-90.0102	39	4	1	2684	3	12	10
B-F	-11.5757	-17.5045	-24.2695	-53.3497	22	11	1	1550	2	14	10
E-F	-14.1999	-20.2169	178.228	143.8112	168	33	36	19745	1	52	59

Interface residues

• A-B: ALA100A, ALA100B, ALA104A, ALA104B, ALA107A, ALA107B, ALA130A, ALA130B, ALA132A, ALA132B, ALA149A, ALA149B, ALA59A, ALA59B, ALA77A, ALA77B, ALA88A, ALA88B, ALA89A, ALA97A, ALA97B, ARG136A, ARG136B, ARG138A, ARG138B, ARG139A, ARG139B, ARG147A, ARG147B, ASN124A, ASN124B, ASN141A, ASN141B, ASN92A, ASN92B, ASP103A, ASP103B, ASP129A, ASP129B, ASP150A, ASP150B, ASP83A, ASP83B, CYS63A, CYS63B, CYS91A, CYS91B, GLN108A, GLN108B, GLN110A, GLN110B, GLN128A, GLN128B, GLN142A, GLN142B, GLN71A, GLN71B, GLN78A, GLN78B, GLN82A, GLN82B, GLN87A, GLN87B, GLU105A, GLU105B, GLU114A, GLU114B, GLU115A, GLU115B, GLU117A, GLU117B, GLU119A, GLU119B, GLU133A, GLU133B, GLU135A, GLU135B, GLU140A, GLU140B, GLU73A, GLU73B, GLU76A, GLU76B, GLU85A, GLU85B, GLY109A, GLY109B, GLY118A, GLY118B, GLY56B, GLY80A, GLY80B, HIS125A, HIS125B, HIS93A, HIS93B, ILE120A, ILE120B, ILE148A, ILE148B, LEU102A, LEU102B, LEU116A, LEU116B, LEU123A, LEU123B, LEU127A, LEU127B, LEU137A, LEU137B, LEU144A, LEU144B, LEU70A, LEU70B, LEU74A, LEU74B, LEU98A, LEU98B, LYS106A, LYS106B, LYS111A, LYS112A, LYS112B, LYS126A, LYS126B, LYS151A, LYS151B, LYS152A, LYS152B, LYS79A, LYS79B, MET96A, MET96B, MET99A, MET99B, PHE81A, PHE81B, PRO155A, PRO155B, SER101A, SER101B, SER131A, SER131B, SER145A, SER145B, SER156A, SER157A, THR121A, THR121B, THR122A, THR122B, THR67A, THR67B, THR90A, THR90B, THR94A, THR94B, TYR153A, TYR154A, TYR154B, VAL113A, VAL113B, VAL134A, VAL134B, VAL143A, VAL143B, VAL146A, VAL146B, VAL60A, VAL60B, VAL66A, VAL66B, VAL84A, VAL84B, VAL95A, VAL95B
• A-E: ALA107A, ALA130E, ALA132A, ARG136A, ARG136E, ARG138A, ARG139A, ARG147E, ASN124A, ASP129A, ASP129E, GLN110A, GLN128A, GLU114A, GLU117A, GLU133A, GLU133E, GLU135A, GLU140E, GLY118A, HIS125A, ILE148E, LEU127A, LEU137E, LEU144E, LYS106A, LYS126E, LYS151E, PRO155E, SER131A, THR121A, THR122A, TYR154E, VAL134A, VAL143E
• A-F: ALA130A, ALA132A, ALA149F, ARG138A, ARG138F, ARG139A, ARG139F, ARG147F, ASN124A, ASN141F, ASP129A, ASP150F, GLN110A, GLN128A, GLN142F, GLU114A, GLU115A, GLU117A, GLU135A, GLU135F, GLU140F, GLY118A, HIS125A, ILE120A, ILE148F, LEU123A, LEU127A, LEU127F, LEU144F, LYS151F, SER131A, SER131F, SER145F, THR121A, VAL113A, VAL134A, VAL134F, VAL143F, VAL146F
• B-F: ALA130B, ALA149F, ARG138F, ARG139F, ARG147F, ASP129B, ASP150F, GLN142F, GLU115B, GLU119B, GLU135F, GLY118B, ILE120B, LEU116B, LEU123B, LEU127B, LYS112B, LYS126B, SER145F, THR122B, VAL143F, VAL146F
• E-F: ALA100E, ALA100F, ALA104E, ALA104F, ALA107E, ALA107F, ALA130E, ALA130F, ALA132E, ALA132F, ALA149E, ALA149F, ALA59E, ALA59F, ALA77E, ALA77F, ALA88E, ALA88F, ALA97E, ALA97F, ARG136E, ARG136F, ARG138E, ARG138F, ARG139E, ARG139F, ARG147E, ARG147F, ARG64F, ASN124E, ASN124F, ASN141E, ASN141F, ASN92E, ASN92F, ASP103E, ASP103F, ASP129E, ASP129F, ASP150F, ASP83E, ASP83F, CYS63E, CYS63F, CYS91E, CYS91F, GLN108E, GLN108F, GLN110E, GLN110F, GLN128E, GLN128F, GLN142E, GLN142F, GLN71E, GLN71F, GLN78E, GLN78F, GLN82E, GLN82F, GLN87E, GLN87F, GLU105E, GLU105F, GLU114E, GLU114F, GLU115E, GLU115F, GLU117E, GLU117F, GLU119E, GLU119F, GLU133E, GLU133F, GLU135E, GLU135F, GLU140E, GLU140F, GLU73E, GLU73F, GLU76E, GLU76F, GLU85E, GLU85F, GLY109E, GLY109F, GLY118E, GLY118F, GLY56E, GLY56F, GLY80E, GLY80F, HIS125E, HIS125F, HIS93E, HIS93F, ILE120E, ILE120F, ILE148E, ILE148F, LEU102E, LEU102F, LEU116E, LEU116F, LEU123E, LEU123F, LEU127E, LEU127F, LEU137E, LEU137F, LEU144E, LEU144F, LEU70E, LEU70F, LEU74E, LEU74F, LEU98E, LEU98F, LYS106E, LYS106F, LYS112E, LYS112F, LYS126E, LYS126F, LYS151E, LYS151F, LYS152E, LYS79E, LYS79F, MET96E, MET96F, MET99E, MET99F, PHE81E, PHE81F, PRO155E, SER101E, SER101F, SER131E, SER131F, SER145E, SER145F, THR121E, THR121F, THR122E, THR122F, THR67E, THR67F, THR90E, THR90F, THR94E, THR94F, VAL113E, VAL113F, VAL134E, VAL134F, VAL143E, VAL143F, VAL146E, VAL146F, VAL60E, VAL60F, VAL66E, VAL66F, VAL84E, VAL84F, VAL95E, VAL95F