3IPL

crystal structure of o-succinylbenzoic acid-coa ligase from staphylococcus aureus subsp. aureus mu50

• Total interactions analyzed: 3
• Total true interactions: 2
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 125
  • Norm. En. per Res.: -3.2138
• 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	-40.9479	-30.3633	-249.459	-320.7702	141	11	1	10473	4	22	18
A-C	-69.1803	-66.3456	-266.197	-401.7228	125	13	0	10109	8	21	17

Interface residues

• A-B: ALA178B, ALA238A, ALA282A, ALA286A, ALA292A, ALA354B, ALA38B, ALA43B, ALA69B, ARG184B, ARG40B, ARG48B, ARG79A, ARG90B, ASN152B, ASN155B, ASN159B, ASN237A, ASN261A, ASN358B, ASN372B, ASN405A, ASN70B, ASN83A, ASN87A, ASP115B, ASP161B, ASP162B, ASP365B, ASP393A, ASP397A, ASP431A, ASP432A, ASP93B, GLN109B, GLN176A, GLN181B, GLN240A, GLN258A, GLN265A, GLN266A, GLN294A, GLN436A, GLN45B, GLN46B, GLN95B, GLU239A, GLU290A, GLU371B, GLU404A, GLU72B, GLU84A, GLY171A, GLY174A, GLY267A, GLY359B, GLY368B, GLY373B, GLY402A, GLY403A, GLY428A, GLY435A, HIS269A, ILE116B, ILE153B, ILE163B, ILE166B, ILE289A, ILE399A, ILE400A, ILE406A, ILE92B, LEU154B, LEU160B, LEU1B, LEU242A, LEU260A, LEU263A, LEU284A, LEU361B, LEU366B, LEU36B, LEU398A, LEU41B, LEU80A, LEU96B, LYS177B, LYS235A, LYS246A, LYS283A, LYS352B, LYS396A, LYS39B, LYS42B, MET264A, MET288A, MET357B, MET85A, PHE118B, PHE158B, PHE236A, PHE370B, PHE375B, PHE3B, PRO150B, PRO180B, PRO257A, PRO363B, PRO408A, PRO430A, PRO82A, SER149B, SER151B, SER157B, SER285A, SER401A, SER47B, SER91B, THR156B, THR172A, THR173A, THR182B, THR243A, THR259A, THR287A, THR291A, THR364B, THR367B, THR369B, THR433A, THR78A, THR81A, TRP262A, TRP434A, TYR212A, TYR295A, TYR360B, TYR362B, TYR374B, TYR44B, VAL356B
• A-C: ALA178A, ALA238C, ALA282C, ALA286C, ALA292C, ALA354A, ALA43A, ARG184A, ARG48A, ARG79C, ASN152A, ASN155A, ASN159A, ASN237C, ASN261C, ASN296C, ASN358A, ASN372A, ASN70A, ASN83C, ASN87C, ASP161A, ASP162A, ASP365A, ASP393C, ASP93A, GLN176C, GLN181A, GLN240C, GLN258C, GLN265C, GLN266C, GLN294C, GLN410A, GLN417A, GLN45A, GLN46A, GLN95A, GLU239C, GLU270C, GLU290C, GLU371A, GLU412A, GLU72A, GLU84C, GLY171C, GLY174C, GLY267C, GLY359A, GLY368A, GLY373A, HIS269C, HIS321C, HIS460A, ILE153A, ILE163A, ILE166A, ILE289C, ILE92A, LEU154A, LEU160A, LEU242C, LEU260C, LEU263C, LEU268C, LEU284C, LEU293C, LEU361A, LEU366A, LEU457A, LEU461A, LEU80C, LYS177A, LYS235C, LYS246C, LYS283C, LYS352A, LYS416A, LYS42A, LYS459A, LYS465A, MET264C, MET288C, MET357A, MET85C, PHE158A, PHE183A, PHE236C, PHE370A, PHE375A, PHE3A, PRO150A, PRO180A, PRO257C, PRO363A, PRO82C, SER149A, SER151A, SER157A, SER285C, SER47A, SER91A, THR156A, THR172C, THR173C, THR182A, THR243C, THR259C, THR287C, THR291C, THR364A, THR367A, THR369A, THR413A, THR78C, THR81C, TRP262C, TYR295C, TYR360A, TYR362A, TYR374A, TYR409A, TYR456A, VAL356A, VAL414A