2GH8

x-ray structure of a native calicivirus

• Total interactions analyzed: 3
• Total true interactions: 3
• Strongest Interaction:
  • Chains: B-C
  • Int. Res.: 125
  • Norm. En. per Res.: -3.6581
• 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	-52.282	-21.0318	-265.543	-338.8569	111	21	5	11368	3	25	23
A-C	-63.1874	-52.1647	-403.251	-518.6032	163	18	12	17660	5	37	43
B-C	-79.7518	-40.2215	-337.283	-457.2563	125	20	11	14220	2	28	29

Interface residues

• A-B: ALA223A, ALA263A, ALA264A, ALA355B, ALA635B, ARG303A, ARG303B, ARG633B, ARG695A, ASN638B, ASN640B, ASP288A, ASP301A, ASP311B, ASP314A, ASP407B, ASP409B, ASP644A, GLN166B, GLN281A, GLN291A, GLN598A, GLN692A, GLU164B, GLU272A, GLU275A, GLU293A, GLU312B, GLU636B, GLY167B, GLY270A, GLY361B, GLY367B, GLY599A, GLY637B, HIS284A, HIS308B, HIS366B, HIS665B, ILE218A, ILE274A, ILE296A, ILE302A, ILE364B, LEU224A, LEU238B, LEU262A, LEU265A, LEU266A, LEU280A, LEU286A, LEU306A, LEU306B, LEU356B, LEU357B, LEU363B, LEU634B, LEU693A, LYS261A, LYS304A, LYS304B, LYS317A, LYS358B, LYS365B, MET279A, MET310B, MET321A, PHE250A, PHE287A, PHE297A, PHE307A, PHE307B, PHE408B, PRO268A, PRO269A, PRO273A, PRO283A, PRO300A, PRO359B, PRO360B, PRO397A, PRO449B, PRO642A, PRO643A, SER240B, SER276A, SER278A, SER309B, SER362B, SER368B, SER410B, SER645A, THR163B, THR241B, THR305A, THR305B, THR313A, THR315A, THR316A, THR411B, TYR239B, TYR282A, TYR639B, VAL267A, VAL271A, VAL277A, VAL285A, VAL295A, VAL319A, VAL691A, VAL696A
• A-C: ALA223C, ALA263C, ALA264C, ALA289C, ALA355A, ALA446A, ALA590A, ALA595C, ALA635A, ALA694C, ARG290C, ARG303A, ARG303C, ARG398C, ARG588C, ARG633A, ARG695C, ASN638A, ASN640A, ASN664C, ASP288C, ASP301C, ASP311A, ASP314C, ASP407A, ASP409A, ASP644C, ASP666C, GLN166A, GLN281C, GLN291C, GLN396C, GLN547A, GLN577C, GLN598C, GLN692C, GLU160A, GLU164A, GLU165A, GLU272C, GLU275C, GLU293C, GLU312A, GLU312C, GLU594C, GLU636A, GLY270C, GLY361A, GLY367A, GLY414A, GLY599C, GLY600C, GLY637A, HIS284C, HIS308A, HIS366A, HIS542C, HIS665A, ILE161A, ILE274C, ILE296C, ILE302C, ILE364A, ILE451A, ILE589A, LEU238A, LEU262C, LEU265C, LEU266C, LEU280C, LEU286C, LEU306A, LEU306C, LEU356A, LEU357A, LEU363A, LEU447A, LEU592A, LEU592C, LEU634A, LEU641A, LEU693C, LYS261C, LYS304A, LYS304C, LYS317C, LYS358A, LYS365A, LYS543A, LYS697C, MET279C, MET310A, MET321C, PHE287C, PHE297C, PHE307A, PHE307C, PHE400C, PHE406A, PHE408A, PHE596C, PRO268C, PRO269C, PRO273C, PRO283C, PRO294C, PRO300C, PRO359A, PRO360A, PRO397C, PRO449A, PRO593A, PRO593C, PRO603C, PRO642C, PRO643A, PRO643C, SER221C, SER240A, SER276C, SER278C, SER309A, SER362A, SER368A, SER402A, SER410A, SER583C, SER584C, SER645C, SER674C, THR163A, THR241A, THR292C, THR305A, THR305C, THR313C, THR315C, THR316C, THR411A, THR412A, THR413A, THR591A, THR591C, THR597C, TRP242A, TRP415A, TYR239A, TYR282C, TYR323C, TYR602C, TYR639A, TYR670C, VAL162A, VAL267C, VAL271C, VAL277C, VAL285C, VAL295C, VAL319C, VAL395C, VAL448A, VAL691C, VAL696C
• B-C: ALA223B, ALA263B, ALA264B, ALA289B, ALA355C, ALA590C, ALA694B, ARG290B, ARG303B, ARG303C, ARG398B, ARG695B, ASN638C, ASP288B, ASP301B, ASP311C, ASP314B, ASP409C, ASP644B, GLN166C, GLN281B, GLN291B, GLN547C, GLN692B, GLU160C, GLU164C, GLU165C, GLU272B, GLU275B, GLU293B, GLU312C, GLU594B, GLU636C, GLY270B, GLY361C, GLY367C, GLY450C, GLY637C, HIS284B, HIS308C, HIS366C, ILE161C, ILE274B, ILE296B, ILE302B, ILE364C, LEU238C, LEU262B, LEU265B, LEU266B, LEU280B, LEU286B, LEU306B, LEU306C, LEU356C, LEU357C, LEU363C, LEU447C, LEU693B, LYS261B, LYS304B, LYS304C, LYS317B, LYS358C, LYS365C, LYS543B, LYS543C, LYS697B, MET279B, MET310C, MET321B, PHE287B, PHE297B, PHE307B, PHE307C, PHE400B, PHE596B, PRO268B, PRO269B, PRO273B, PRO283B, PRO294B, PRO300B, PRO359C, PRO360C, PRO397B, PRO449C, PRO642B, PRO643B, SER240C, SER276B, SER278B, SER309C, SER362C, SER368C, SER410C, SER583B, SER584B, SER645B, THR163C, THR241C, THR292B, THR305B, THR305C, THR313B, THR315B, THR316B, THR411C, THR591B, THR591C, TRP242C, TYR239C, TYR282B, TYR323B, TYR639C, VAL162C, VAL267B, VAL271B, VAL277B, VAL285B, VAL295B, VAL319B, VAL448C, VAL691B, VAL696B