2AHB

x-ray crystal structure of r46a,r161a mutant of mycobacterium tuberculosis fabh

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 299
  • Norm. En. per Res.: -3.737
• 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	-186.3523	-32.2866	-898.738	-1117.3769	299	59	21	35804	2	27	30

Interface residues

• A-B: ALA100A, ALA100B, ALA101A, ALA101B, ALA105A, ALA105B, ALA106A, ALA106B, ALA110A, ALA110B, ALA120A, ALA120B, ALA123A, ALA123B, ALA128A, ALA128B, ALA131A, ALA131B, ALA132A, ALA132B, ALA133A, ALA133B, ALA141A, ALA141B, ALA189A, ALA189B, ALA196A, ALA196B, ALA198A, ALA198B, ALA209A, ALA209B, ALA241A, ALA241B, ALA244A, ALA244B, ALA245A, ALA245B, ALA314A, ALA314B, ALA321A, ALA321B, ALA326A, ALA326B, ALA5A, ALA5B, ALA61B, ARG11A, ARG11B, ARG137A, ARG137B, ARG200A, ARG200B, ARG216A, ARG216B, ARG220A, ARG220B, ARG240A, ARG240B, ARG248A, ARG248B, ARG275A, ARG331A, ARG331B, ASN211A, ASN211B, ASN91A, ASN91B, ASP117A, ASP117B, ASP134A, ASP134B, ASP192A, ASP192B, ASP197A, ASP197B, ASP202A, ASP202B, ASP204A, ASP204B, ASP243A, ASP243B, ASP250A, ASP253A, ASP253B, ASP312A, ASP312B, ASP57A, ASP57B, ASP84A, ASP84B, CYS122A, CYS122B, GLN182A, GLN182B, GLN195A, GLN195B, GLN201A, GLN201B, GLN210A, GLN210B, GLN251A, GLN251B, GLN328A, GLN328B, GLN96A, GLN96B, GLU150A, GLU150B, GLU194A, GLU194B, GLU3A, GLU3B, GLY109A, GLY109B, GLY112A, GLY112B, GLY115A, GLY115B, GLY121A, GLY121B, GLY124A, GLY124B, GLY130A, GLY130B, GLY138A, GLY138B, GLY139A, GLY139B, GLY140A, GLY140B, GLY14A, GLY183A, GLY183B, GLY185A, GLY185B, GLY190A, GLY190B, GLY193A, GLY193B, GLY214A, GLY214B, GLY246A, GLY246B, GLY311A, GLY311B, GLY320A, GLY320B, GLY322A, GLY322B, GLY85A, GLY85B, GLY9A, HIS93A, HIS93B, ILE113A, ILE113B, ILE136A, ILE136B, ILE156A, ILE156B, ILE184A, ILE184B, ILE199A, ILE199B, ILE203A, ILE203B, ILE206A, ILE206B, ILE252A, ILE252B, ILE4A, ILE4B, ILE87A, ILE87B, LEU114A, LEU114B, LEU118A, LEU118B, LEU152A, LEU152B, LEU15A, LEU221B, LEU313A, LEU313B, LEU323A, LEU323B, LEU95A, LEU95B, LYS111A, LYS111B, LYS151A, LYS151B, LYS233B, MET103A, MET103B, MET135A, MET135B, MET144A, MET144B, MET1A, MET1B, MET242A, MET242B, MET332A, PHE116A, PHE116B, PHE167A, PHE167B, PHE181A, PHE181B, PHE208A, PHE208B, PHE218A, PHE218B, PHE94A, PHE94B, PRO102A, PRO102B, PRO154A, PRO154B, PRO186A, PRO186B, PRO212A, PRO212B, PRO215A, PRO215B, PRO217A, PRO217B, PRO98A, PRO98B, PRO99A, PRO99B, SER107A, SER107B, SER119A, SER119B, SER12A, SER12B, SER153A, SER153B, SER191A, SER191B, SER213A, SER213B, SER291A, SER291B, SER324A, SER324B, SER60A, SER60B, SER8A, SER8B, THR155A, THR155B, THR179B, THR187A, THR187B, THR207A, THR207B, THR2A, THR2B, THR6A, THR6B, THR7A, THR7B, THR89A, THR89B, THR90A, THR90B, THR92A, THR92B, THR97A, THR97B, TRP205A, TRP205B, TRP229B, TYR127A, TYR127B, TYR325A, TYR325B, VAL104A, VAL104B, VAL13A, VAL13B, VAL188A, VAL188B, VAL219A, VAL219B, VAL247A, VAL247B, VAL329A, VAL329B, VAL330A, VAL330B, VAL86A, VAL86B, VAL88A, VAL88B