1YU4

major tropism determinant u1 variant

• Total interactions analyzed: 3
• Total true interactions: 3
• Strongest Interaction:
  • Chains: B-C
  • Int. Res.: 234
  • Norm. En. per Res.: -3.206
• 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	-128.8529	72.6393	-670.575	-726.7886	236	24	20	26067	1	54	59
A-C	-119.1877	69.8278	-690.704	-740.0639	238	23	21	26711	1	52	59
B-C	-129.0836	48.9184	-670.033	-750.1982	234	26	20	26200	1	53	60

Interface residues

• A-B: ALA13B, ALA151A, ALA152A, ALA175B, ALA176B, ALA186A, ALA188A, ALA21B, ALA22B, ALA237B, ALA242B, ALA260A, ALA262A, ALA268A, ALA319B, ALA324B, ALA334B, ALA337A, ALA337B, ALA338B, ALA339A, ALA339B, ALA355A, ALA356A, ALA40B, ALA48A, ALA48B, ALA56A, ALA56B, ALA60A, ALA64A, ARG137A, ARG137B, ARG173B, ARG23B, ARG251A, ARG251B, ARG329B, ARG354A, ARG49A, ARG49B, ARG8A, ARG8B, ASN240B, ASN254A, ASN254B, ASN256A, ASN311A, ASN311B, ASN317A, ASN317B, ASN325B, ASN32A, ASN32B, ASN344A, ASN350A, ASN357A, ASN359A, ASN368A, ASN86A, ASP115A, ASP235B, ASP28A, ASP28B, ASP30B, ASP376A, ASP376B, ASP38B, ASP51A, ASP51B, ASP61A, GLN153A, GLN259A, GLN335B, GLN6A, GLN6B, GLN91A, GLN91B, GLU243B, GLU24B, GLU257A, GLU267A, GLU312A, GLU312B, GLU321B, GLU84A, GLU84B, GLY10A, GLY187A, GLY20B, GLY226B, GLY227B, GLY249B, GLY264A, GLY310B, GLY314A, GLY314B, GLY315A, GLY315B, GLY318B, GLY327B, GLY328B, GLY330B, GLY342A, GLY343A, GLY352A, GLY39B, GLY44B, GLY80A, GLY87A, GLY9A, HIS15A, HIS247B, HIS248B, HIS377A, HIS37B, HIS50A, HIS50B, ILE170B, ILE25A, ILE25B, ILE379A, ILE379B, ILE58A, ILE82A, LEU177B, LEU184A, LEU252B, LEU261A, LEU340A, LEU378A, LEU378B, LEU380A, LEU380B, LEU47A, LEU47B, LEU52A, LEU52B, LEU89A, LEU89B, LYS171A, LYS171B, LYS221B, LYS224B, LYS250B, LYS296A, LYS31A, LYS31B, LYS54A, LYS54B, LYS59A, LYS62A, LYS88A, MET245B, PHE172A, PHE189A, PHE18B, PHE225B, PHE241B, PHE258A, PHE263A, PHE313A, PHE313B, PHE341A, PHE45A, PHE45B, PHE57A, PHE57B, PHE7A, PHE7B, PRO336A, PRO336B, PRO362B, PRO46A, PRO46B, SER222B, SER295A, SER303A, SER320B, SER331B, SER347A, SER349A, SER351A, SER353A, SER360A, SER363B, SER63A, THR12B, THR223B, THR246B, THR265A, THR266A, THR269A, THR26A, THR26B, THR29A, THR323B, THR326B, THR33A, THR33B, THR348A, THR41A, THR41B, THR55A, THR55B, THR93A, TRP238B, TRP297A, TRP307A, TRP358A, TRP358B, TYR165A, TYR233B, TYR239B, TYR255A, TYR322B, TYR333B, VAL185A, VAL244B, VAL27A, VAL316A, VAL316B, VAL332B, VAL34A, VAL34B, VAL35A, VAL35B, VAL36A, VAL36B, VAL53A, VAL53B, VAL5A, VAL5B, VAL83A, VAL85A, VAL90A
• A-C: ALA13A, ALA151C, ALA152C, ALA175A, ALA176A, ALA186C, ALA188C, ALA21A, ALA22A, ALA237A, ALA242A, ALA260C, ALA262C, ALA268C, ALA319A, ALA324A, ALA334A, ALA337A, ALA337C, ALA338A, ALA339A, ALA339C, ALA355C, ALA356C, ALA40A, ALA48A, ALA48C, ALA56A, ALA56C, ALA60C, ALA64C, ARG137A, ARG137C, ARG173A, ARG23A, ARG251A, ARG251C, ARG329A, ARG354C, ARG49A, ARG49C, ARG8A, ARG8C, ASN240A, ASN254A, ASN254C, ASN256C, ASN311A, ASN311C, ASN317A, ASN317C, ASN325A, ASN32A, ASN32C, ASN344C, ASN350C, ASN357C, ASN359C, ASN368C, ASN86C, ASP115C, ASP235A, ASP28A, ASP28C, ASP30A, ASP376A, ASP376C, ASP38A, ASP51A, ASP51C, ASP61C, GLN153C, GLN259C, GLN335A, GLN6A, GLN6C, GLN91A, GLN91C, GLU243A, GLU24A, GLU257C, GLU267C, GLU312A, GLU312C, GLU321A, GLU84C, GLY10C, GLY187C, GLY20A, GLY226A, GLY227A, GLY249A, GLY264C, GLY310A, GLY314A, GLY314C, GLY315A, GLY315C, GLY318A, GLY327A, GLY328A, GLY330A, GLY342C, GLY343C, GLY352C, GLY39A, GLY44A, GLY80C, GLY87C, GLY9C, HIS15A, HIS15C, HIS247A, HIS248A, HIS377C, HIS37A, HIS50A, HIS50C, ILE170A, ILE25A, ILE25C, ILE379A, ILE379C, ILE58C, ILE82C, LEU177A, LEU184C, LEU252A, LEU261C, LEU340C, LEU378A, LEU378C, LEU380A, LEU380C, LEU47A, LEU47C, LEU52A, LEU52C, LEU89A, LEU89C, LYS171A, LYS171C, LYS221A, LYS224A, LYS250A, LYS296C, LYS31A, LYS31C, LYS54A, LYS54C, LYS59C, LYS62C, LYS88C, MET245A, PHE172C, PHE189C, PHE18A, PHE225A, PHE241A, PHE258C, PHE263C, PHE313A, PHE313C, PHE341C, PHE45A, PHE45C, PHE57A, PHE57C, PHE7A, PHE7C, PRO336A, PRO336C, PRO362A, PRO46A, PRO46C, SER222A, SER295C, SER303C, SER320A, SER331A, SER347C, SER349C, SER351C, SER353C, SER360C, SER363A, SER63C, THR11A, THR12A, THR223A, THR246A, THR265C, THR266C, THR269C, THR26A, THR26C, THR29A, THR29C, THR323A, THR326A, THR33A, THR33C, THR348C, THR41A, THR55A, THR55C, THR81C, THR93C, TRP238A, TRP297C, TRP307C, TRP358A, TRP358C, TYR165C, TYR233A, TYR239A, TYR255C, TYR322A, TYR333A, VAL185C, VAL244A, VAL27C, VAL316A, VAL316C, VAL332A, VAL34A, VAL34C, VAL35A, VAL35C, VAL36A, VAL36C, VAL53A, VAL53C, VAL5A, VAL5C, VAL83C, VAL85C, VAL90C
• B-C: ALA151B, ALA152B, ALA175C, ALA176C, ALA186B, ALA188B, ALA21C, ALA22C, ALA237C, ALA242C, ALA260B, ALA262B, ALA268B, ALA319C, ALA324C, ALA334C, ALA337B, ALA337C, ALA338C, ALA339B, ALA339C, ALA355B, ALA356B, ALA40C, ALA48B, ALA48C, ALA56B, ALA56C, ALA60B, ALA64B, ARG137B, ARG137C, ARG173C, ARG23C, ARG251B, ARG251C, ARG329C, ARG354B, ARG49B, ARG49C, ARG8B, ARG8C, ASN240C, ASN254B, ASN254C, ASN256B, ASN311B, ASN311C, ASN317B, ASN317C, ASN325C, ASN32B, ASN32C, ASN344B, ASN350B, ASN357B, ASN359B, ASN368B, ASN86B, ASP235C, ASP28B, ASP28C, ASP30C, ASP376B, ASP376C, ASP38C, ASP51B, ASP51C, ASP61B, GLN153B, GLN259B, GLN335C, GLN6B, GLN6C, GLN91B, GLN91C, GLU243C, GLU24C, GLU257B, GLU267B, GLU312B, GLU312C, GLU321C, GLU84B, GLY10B, GLY187B, GLY20C, GLY226C, GLY227C, GLY249C, GLY264B, GLY310C, GLY314B, GLY314C, GLY315B, GLY315C, GLY318C, GLY327C, GLY328C, GLY330C, GLY342B, GLY343B, GLY352B, GLY39C, GLY44C, GLY80B, GLY87B, GLY9B, HIS15B, HIS247C, HIS248C, HIS377B, HIS37C, HIS50B, HIS50C, ILE170C, ILE25B, ILE25C, ILE379B, ILE379C, ILE58B, ILE82B, LEU177C, LEU184B, LEU252C, LEU261B, LEU340B, LEU378B, LEU378C, LEU380B, LEU380C, LEU47B, LEU47C, LEU52B, LEU52C, LEU89B, LEU89C, LYS171B, LYS171C, LYS221C, LYS224C, LYS250C, LYS296B, LYS31B, LYS31C, LYS54B, LYS54C, LYS59B, LYS62B, LYS88B, MET245C, PHE172B, PHE189B, PHE18C, PHE225C, PHE241C, PHE258B, PHE263B, PHE313B, PHE313C, PHE341B, PHE45B, PHE45C, PHE57B, PHE57C, PHE7B, PHE7C, PRO336B, PRO336C, PRO362C, PRO46B, PRO46C, SER222C, SER295B, SER303B, SER320C, SER331C, SER347B, SER349B, SER351B, SER353B, SER360B, SER363C, SER63B, THR11C, THR12C, THR223C, THR246C, THR265B, THR266B, THR269B, THR26B, THR26C, THR29B, THR29C, THR323C, THR326C, THR33B, THR33C, THR348B, THR41C, THR55B, THR55C, THR93B, TRP238C, TRP297B, TRP307B, TRP358B, TRP358C, TYR165B, TYR233C, TYR239C, TYR255B, TYR322C, TYR333C, VAL185B, VAL244C, VAL27B, VAL316B, VAL316C, VAL332C, VAL34B, VAL34C, VAL35B, VAL35C, VAL36B, VAL36C, VAL53B, VAL53C, VAL5B, VAL5C, VAL83B, VAL85B, VAL90B