3I1K

structure of porcine torovirus hemagglutinin-esterase

• Total interactions analyzed: 3
• Total true interactions: 3
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 15
  • Norm. En. per Res.: -2.8158
• 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	0.0	-4.8748	-44.407	-49.2818	48	0	0	2061	1	9	9
A-C	-9.2508	-16.8365	-16.1494	-42.2367	15	0	0	633	2	1	2
B-C	-14.2498	5.3484	-331.391	-340.2924	151	14	9	12369	0	9	10

Interface residues

• A-B: ALA172A, ARG113A, ARG144B, ARG302A, ASN114A, ASN168A, ASN286B, ASN335A, ASN96B, ASP200B, ASP283B, ASP39B, ASP90A, CYS145B, CYS97B, GLN119A, GLY167A, GLY169A, GLY170A, GLY201B, GLY86A, GLY88A, GLY98B, HIS112A, HIS336A, LEU249A, LYS101B, LYS147B, MET285B, PHE89A, PRO38B, SER143B, SER198B, SER199B, SER203B, SER87A, THR116A, THR142B, THR171A, THR205B, THR284B, TRP298A, TYR115A, TYR287B, VAL166A, VAL202B, VAL289B, VAL99B
• A-C: ALA247A, CYS218A, CYS225A, GLU220A, GLU369C, GLY223A, LYS384C, MET221A, MET370C, SER222A, SER368C, TYR372C, TYR382C, TYR383C, VAL224A
• B-C: ALA364B, ALA364C, ASN244B, ASN244C, ASN286B, ASN286C, ASN375B, ASN375C, ASP215B, ASP215C, ASP255B, ASP255C, CYS218B, CYS317B, CYS317C, CYS354B, CYS354C, CYS379B, CYS379C, GLN358B, GLN358C, GLN381B, GLN381C, GLU233B, GLU233C, GLY216B, GLY216C, GLY217B, GLY229B, GLY229C, GLY240B, GLY240C, GLY245B, GLY245C, GLY377B, GLY377C, HIS239B, HIS239C, ILE253B, ILE253C, ILE27B, ILE27C, ILE318B, ILE318C, ILE36C, ILE371B, ILE371C, ILE373B, ILE373C, LEU363B, LEU363C, LEU365B, LEU365C, LEU385B, LEU385C, LYS188B, LYS188C, LYS313B, LYS313C, LYS384B, LYS384C, MET285B, MET370B, MET370C, PHE211B, PHE211C, PHE228B, PHE237B, PHE237C, PHE241B, PHE241C, PHE269B, PHE269C, PHE386B, PHE386C, PRO227B, PRO227C, PRO235B, PRO235C, PRO290B, PRO290C, PRO315B, PRO315C, PRO357B, PRO357C, PRO362B, PRO362C, PRO374B, PRO374C, PRO380B, PRO380C, SER138B, SER138C, SER141B, SER141C, SER234B, SER234C, SER236B, SER236C, SER251B, SER314B, SER314C, SER353B, SER353C, SER367B, SER367C, SER378B, SER378C, THR142B, THR142C, THR243B, THR243C, THR246B, THR246C, THR267B, THR267C, THR268B, THR268C, THR288B, THR288C, THR361B, THR361C, TYR213B, TYR213C, TYR230B, TYR230C, TYR231B, TYR231C, TYR238B, TYR238C, TYR242B, TYR242C, TYR287B, TYR287C, TYR316B, TYR316C, TYR366B, TYR366C, TYR372B, TYR372C, TYR376B, TYR376C, TYR382B, TYR382C, TYR383B, TYR383C, VAL289B, VAL289C, VAL291B, VAL355B, VAL355C