3N1F

crystal structure of ihhn bound to cdofn3

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: A-D
  • Int. Res.: 66
  • Norm. En. per Res.: -5.895
• 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	0.0	0.0	-1.8957	-1.8957	12	0	0	209	0	1	5
A-C	0.0	5.1773	-66.6217	-61.4444	43	4	0	2693	0	15	16
A-D	-91.0912	-124.8357	-173.143	-389.0699	66	11	0	6351	8	57	47
B-C	-80.8716	-122.2842	-169.437	-372.5928	69	9	0	6523	8	57	48
B-D	0.0	12.9191	-70.8984	-57.9793	46	3	0	2883	0	16	17
C-D	0.0	4.4448	-1.45	2.9948	10	0	0	243	0	2	8

Interface residues

• A-B: ARG101A, ARG101B, ASN96A, ASN96B, ASP93A, ASP93B, GLY98A, GLY98B, THR97A, THR97B, TYR85A, TYR85B
• A-C: ARG101A, ARG128A, ARG158A, ARG879C, ASN112A, ASN84A, ASN86A, ASN873C, ASP109A, ASP874C, ASP876C, ASP88A, ASP93A, CYS906C, GLN105A, GLN905C, GLU912C, GLU914C, GLY910C, GLY911C, ILE827C, ILE89A, ILE90A, LYS108A, LYS126A, LYS903C, LYS92A, MET119A, PHE907C, PHE915C, PHE91A, PRO826C, PRO83A, PRO87A, SER156A, SER875C, SER913C, THR82A, TYR85A, TYR863C, TYR865C, TYR877C, VAL881C
• A-D: ALA184A, ALA833D, ARG128A, ARG158A, ARG160A, ARG867D, ASN873D, ASN917D, ASN96A, ASP100A, ASP134A, ASP136A, ASP152A, ASP157A, ASP159A, ASP870D, ASP872D, ASP874D, ASP901D, ASP93A, CYS921D, GLU131A, GLU135A, GLU181A, GLU897D, GLU922D, GLU94A, GLU95A, GLY137A, HIS138A, HIS139A, HIS185A, HIS831D, ILE832D, ILE902D, ILE90A, ILE920D, LYS183A, LYS70A, LYS903D, LYS924D, LYS92A, MET919D, PHE915D, PHE91A, PRO868D, PRO896D, SER156A, SER182A, SER871D, SER899D, SER916D, THR130A, THR154A, THR835D, THR869D, THR898D, THR97A, TYR146A, TYR163A, TYR49A, TYR834D, TYR877D, TYR900D, VAL129A, VAL918D
• B-C: ALA184B, ALA833C, ARG128B, ARG158B, ARG160B, ARG867C, ASN873C, ASN917C, ASN96B, ASP100B, ASP134B, ASP136B, ASP152B, ASP157B, ASP159B, ASP870C, ASP872C, ASP874C, ASP901C, ASP93B, CYS921C, GLN895C, GLU131B, GLU135B, GLU141B, GLU181B, GLU897C, GLU922C, GLU94B, GLU95B, GLY137B, HIS138B, HIS139B, HIS185B, HIS831C, ILE832C, ILE902C, ILE90B, ILE920C, LYS183B, LYS50B, LYS903C, LYS924C, LYS92B, MET919C, PHE915C, PHE91B, PRO868C, PRO896C, SER156B, SER182B, SER871C, SER899C, SER916C, THR130B, THR154B, THR835C, THR869C, THR898C, THR923C, THR97B, TYR146B, TYR163B, TYR49B, TYR834C, TYR877C, TYR900C, VAL129B, VAL918C
• B-D: ARG101B, ARG128B, ARG158B, ARG879D, ASN112B, ASN84B, ASN86B, ASN873D, ASN96B, ASP874D, ASP876D, ASP88B, ASP93B, CYS906D, GLN105B, GLN905D, GLU909D, GLU912D, GLU914D, GLY910D, GLY911D, ILE827D, ILE89B, ILE90B, LYS108B, LYS126B, LYS878D, LYS903D, LYS92B, MET119B, PHE907D, PHE915D, PHE91B, PRO826D, PRO83B, PRO87B, SER156B, SER875D, SER913D, THR825D, THR82B, TYR85B, TYR863D, TYR865D, TYR877D, VAL881D
• C-D: ASN873C, ASN873D, ASP872C, ASP872D, ASP874C, ASP874D, SER871C, SER871D, SER875C, SER875D