3N3N

crystal structure of b. pseudomallei katg with isonicotinic acid hydrazide bound

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 341
  • Norm. En. per Res.: -3.8232
• Hub Node: A(1)

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	-139.523	-116.7522	-1047.44	-1303.7152	341	21	4	38801	5	116	112

Interface residues

• A-B: ALA134A, ALA134B, ALA162A, ALA162B, ALA295A, ALA295B, ALA299A, ALA299B, ALA300A, ALA300B, ALA304A, ALA304B, ALA613A, ALA613B, ALA628A, ALA628B, ALA682A, ALA682B, ALA691A, ALA691B, ALA714A, ALA714B, ALA716A, ALA716B, ALA71A, ALA71B, ALA722A, ALA722B, ALA724A, ALA724B, ARG132A, ARG132B, ARG149A, ARG149B, ARG150A, ARG150B, ARG161A, ARG161B, ARG218A, ARG218B, ARG40A, ARG40B, ARG54A, ARG54B, ARG690A, ARG690B, ARG701A, ARG701B, ARG713A, ARG713B, ARG730A, ASN137A, ASN137B, ASN216A, ASN216B, ASN35A, ASN35B, ASN39A, ASN39B, ASN45A, ASN45B, ASN662A, ASN662B, ASN667A, ASN667B, ASP146A, ASP146B, ASP193A, ASP193B, ASP199A, ASP199B, ASP41A, ASP41B, ASP48A, ASP48B, ASP60A, ASP60B, ASP670A, ASP670B, ASP683A, ASP683B, ASP703A, ASP703B, ASP723A, ASP723B, ASP731A, ASP731B, ASP93A, ASP93B, GLN130A, GLN130B, GLN131A, GLN131B, GLN157A, GLN157B, GLN305A, GLN305B, GLN46A, GLN46B, GLN711A, GLN711B, GLN725A, GLN725B, GLN92A, GLN92B, GLU196A, GLU196B, GLU198A, GLU198B, GLU205A, GLU205B, GLU210A, GLU210B, GLU226B, GLU296A, GLU296B, GLU298A, GLU298B, GLU303A, GLU303B, GLU614A, GLU614B, GLU630A, GLU630B, GLU674A, GLU674B, GLU686A, GLU686B, GLU717A, GLU717B, GLU726A, GLU726B, GLY160A, GLY160B, GLY203A, GLY203B, GLY235A, GLY235B, GLY301A, GLY301B, GLY306A, GLY306B, GLY36A, GLY36B, GLY63A, GLY63B, GLY672A, GLY672B, GLY687A, GLY687B, GLY707A, GLY707B, GLY720A, GLY720B, HIS53A, HIS53B, HIS55A, HIS55B, HIS709A, HIS709B, ILE155A, ILE155B, ILE163A, ILE163B, ILE207A, ILE207B, ILE302A, ILE302B, ILE51A, ILE51B, LEU136A, LEU136B, LEU151A, LEU151B, LEU209A, LEU209B, LEU229A, LEU229B, LEU307A, LEU307B, LEU47A, LEU47B, LEU49A, LEU49B, LEU52A, LEU52B, LEU58A, LEU58B, LEU626A, LEU626B, LEU668A, LEU668B, LEU669A, LEU669B, LEU704A, LEU704B, LEU712A, LEU712B, LEU715A, LEU715B, LYS147A, LYS147B, LYS156A, LYS156B, LYS158A, LYS158B, LYS206A, LYS206B, LYS310A, LYS310B, LYS317A, LYS317B, LYS64A, LYS64B, LYS676A, LYS676B, LYS727A, LYS727B, LYS738A, LYS738B, MET234A, MET234B, MET62A, MET62B, MET671A, MET671B, PHE133A, PHE133B, PHE653A, PHE653B, PHE665A, PHE665B, PHE66A, PHE66B, PHE685A, PHE685B, PHE706A, PHE706B, PHE728B, PRO135A, PRO135B, PRO140A, PRO140B, PRO154A, PRO154B, PRO197A, PRO197B, PRO297A, PRO297B, PRO44A, PRO44B, PRO612A, PRO612B, PRO61A, PRO61B, PRO629A, PRO629B, PRO677A, PRO677B, SER138A, SER138B, SER204A, SER204B, SER38A, SER38B, SER50A, SER50B, SER56A, SER56B, SER57A, SER57B, SER59A, SER59B, SER627A, SER627B, SER708A, SER708B, SER710A, SER710B, SER721A, SER721B, THR194A, THR194B, THR37A, THR37B, THR625A, THR625B, THR632A, THR632B, THR673A, THR673B, THR700A, THR700B, TRP139A, TRP139B, TRP153A, TRP153B, TRP165A, TRP165B, TRP195A, TRP195B, TRP202A, TRP202B, TRP208A, TRP208B, TRP309A, TRP309B, TRP42A, TRP42B, TRP43A, TRP43B, TRP675A, TRP675B, TRP94A, TRP94B, TRP95A, TRP95B, TYR159A, TYR159B, TYR201A, TYR201B, TYR719A, TYR719B, VAL200A, VAL200B, VAL611A, VAL611B, VAL615A, VAL615B, VAL633A, VAL633B, VAL666A, VAL666B, VAL684A, VAL684B, VAL702A, VAL702B, VAL705A, VAL705B, VAL718A, VAL718B