3CO0

substrate complex of fluoride-sensitive engineered subtilisin subt_bacam

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: P-S
  • Int. Res.: 113
  • Norm. En. per Res.: -5.3311
• Hub Node: P(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
P-S	-168.4894	-22.0954	-411.824	-602.4089	113	33	21	14467	0	11	9

Interface residues

• P-S: ALA104S, ALA114S, ALA116S, ALA133S, ALA134S, ALA137S, ALA138S, ALA142S, ALA151S, ALA152S, ALA153S, ALA169S, ALA216S, ALA221S, ALA223S, ALA32S, ALA46P, ALA47P, ALA49P, ALA66P, ALA76P, ALA79P, ARG75P, ASN109S, ASN117S, ASN118S, ASN155S, ASN62S, ASP140S, ASP45P, ASP71P, ASP99S, CYS40P, GLN103S, GLN38P, GLU112S, GLU69P, GLU70P, GLY100S, GLY102S, GLY110S, GLY127S, GLY131S, GLY154S, GLY15P, GLY202S, GLY219S, GLY65S, GLY97S, HIS64S, HIS67S, ILE107S, ILE108S, ILE111S, ILE115S, ILE13P, ILE205S, LEU126S, LEU135S, LEU217S, LEU31S, LEU73P, LEU77P, LEU96S, LYS11P, LYS136S, LYS141S, LYS170S, LYS39P, LYS42P, LYS72P, MET124S, MET222S, PHE189S, PHE41P, PHE50S, PRO129S, PRO168S, PRO52S, SER101S, SER105S, SER125S, SER128S, SER130S, SER132S, SER145S, SER156S, SER166S, SER191S, SER218S, SER224S, SER33S, SER48P, SER49S, SER63S, SER78P, THR220S, THR50P, TRP106S, TRP113S, TYR12P, TYR167S, TYR171S, TYR43P, TYR67P, TYR74P, VAL139S, VAL14P, VAL165S, VAL177S, VAL44P, VAL68S, VAL95S