3NIS

the structure of ubr box (native2)

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: B-D
  • Int. Res.: 51
  • Norm. En. per Res.: -3.9191
• 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	-72.429	-7.3614	-109.528	-189.3184	53	9	0	4505	1	26	12
A-D	-14.1207	14.7884	-50.7828	-50.1151	25	1	0	2033	0	23	10
A-F	-44.4566	-9.1286	-113.684	-167.2692	56	9	1	4786	5	25	48
B-D	-66.5969	-17.6899	-115.586	-199.8728	51	11	0	4108	1	18	10
B-F	0.0	2.5937	-8.3996	-5.8059	23	0	0	568	0	6	8
D-F	0.0	-40.7638	-28.5369	-69.3007	21	0	0	1287	4	10	6

Interface residues

• A-B: ALA182A, ALA191B, ARG125A, ARG125B, ARG135A, ASP142A, ASP143A, ASP165A, ASP176A, ASP179A, CYS141A, CYS145A, CYS148B, CYS151B, CYS167A, CYS175A, CYS177A, GLN194B, GLU131B, GLU169A, GLY113B, GLY124A, GLY130B, GLY173A, HIS116B, HIS118B, HIS137A, HIS150B, ILE129B, ILE149B, ILE166A, ILE174A, LEU133A, LEU147A, LYS117B, LYS126A, LYS128B, LYS190B, PHE127A, PHE152B, PHE170A, PRO132B, SER114B, SER172A, THR119B, THR144A, THR168A, THR171A, TRP183A, TYR134A, TYR134B, VAL115B, VAL146A
• A-D: ALA182A, ASN153D, ASN159D, ASN184A, ASP142A, ASP143A, ASP156D, ASP179A, CYS139A, CYS141A, CYS145A, GLU138A, GLU180A, GLU181A, GLU192D, GLU193D, GLY140A, HIS137A, HIS157D, LYS155D, LYS190D, PRO154D, SER185A, TRP183A, VAL158D
• A-F: ALA182A, ALA182F, ARG121A, ARG121F, ARG125A, ARG125F, ASN122A, ASN122F, ASP176A, ASP176F, ASP179A, ASP179F, CYS123A, CYS123F, CYS148A, CYS148F, CYS151A, CYS151F, CYS175A, CYS175F, GLU169A, GLU169F, GLU180A, GLU180F, GLU181A, GLU181F, GLY120A, GLY120F, GLY124A, GLY124F, GLY173A, GLY173F, GLY178A, GLY178F, HIS116A, HIS116F, HIS118A, HIS118F, HIS150A, HIS150F, ILE129F, ILE174A, ILE174F, LYS117A, LYS117F, LYS126A, LYS126F, LYS128A, LYS128F, PHE127A, PHE127F, SER114F, THR119A, THR119F, THR171F, VAL115F
• B-D: ARG135B, ARG135D, ASN159B, ASN159D, ASP165B, ASP165D, CYS136B, CYS136D, CYS163B, CYS163D, CYS167B, CYS167D, GLU131B, GLU131D, GLU138B, GLU138D, GLY130B, GLY130D, HIS137B, HIS137D, HIS157B, HIS157D, HIS160B, HIS160D, HIS161B, HIS161D, ILE129B, ILE149B, ILE149D, ILE166B, ILE166D, LEU133B, LEU133D, LYS128B, PHE152B, PHE152D, PRO132B, PRO132D, PRO154B, PRO154D, THR164B, THR164D, THR168B, THR168D, THR171B, TYR134B, TYR134D, VAL158B, VAL158D, VAL162B, VAL162D
• B-F: ALA182F, ASP142F, ASP143F, ASP176F, ASP179F, CYS145F, GLN194B, GLU181F, GLU192B, GLU193B, GLY113B, GLY173F, ILE174F, LYS117B, LYS155B, LYS190B, PHE170F, PRO154B, SER172F, THR144F, THR171F, VAL146F, VAL158B
• D-F: ALA191D, ARG125D, CYS151D, GLU169F, GLU193D, GLY113D, GLY130F, HIS116D, HIS150D, ILE129F, ILE149D, LYS117D, LYS126F, LYS128F, LYS190D, PHE170F, PRO132D, SER114D, THR168F, TYR134D, VAL115D