3AYL

x-ray crystal structures of l-phenylalanine oxidase (deaminating and decaboxylating) from pseudomonas sp. p501. structures of the enzyme- ligand complex and catalytic mechanism

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 361
  • Norm. En. per Res.: -3.7196
• 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	-164.5802	-243.9297	-934.27	-1342.7799	361	44	18	38253	18	142	117

Interface residues

• A-B: ALA262A, ALA262B, ALA271A, ALA271B, ALA272A, ALA272B, ALA375A, ALA375B, ALA427A, ALA427B, ALA428A, ALA428B, ALA435A, ALA435B, ALA459A, ALA459B, ALA460A, ALA460B, ALA462A, ALA462B, ALA467A, ALA467B, ALA474A, ALA474B, ALA511A, ALA511B, ALA574A, ALA574B, ALA583A, ALA586A, ALA586B, ALA596A, ALA596B, ALA614A, ALA614B, ARG183A, ARG183B, ARG274A, ARG274B, ARG308A, ARG308B, ARG373A, ARG373B, ARG421A, ARG421B, ARG463A, ARG463B, ARG475A, ARG475B, ARG544A, ARG544B, ARG546A, ARG546B, ARG568A, ARG568B, ARG573A, ARG573B, ARG576A, ARG576B, ARG603A, ARG603B, ARG633A, ARG633B, ARG699A, ARG699B, ASN182A, ASN182B, ASN321A, ASN321B, ASN376A, ASN376B, ASN431A, ASN431B, ASN461A, ASN461B, ASN572A, ASN572B, ASN585A, ASN585B, ASN611A, ASN611B, ASN629A, ASN629B, ASP265A, ASP265B, ASP290A, ASP290B, ASP294A, ASP294B, ASP296A, ASP296B, ASP413A, ASP413B, ASP434A, ASP434B, ASP507A, ASP507B, ASP540A, ASP540B, ASP541A, ASP541B, ASP548A, ASP548B, ASP564A, ASP564B, ASP607A, ASP607B, ASP620A, ASP620B, ASP624A, ASP624B, GLN263A, GLN263B, GLN414A, GLN414B, GLN430A, GLN430B, GLN446B, GLN470A, GLN470B, GLN587A, GLN587B, GLN627A, GLN627B, GLU275A, GLU275B, GLU297A, GLU297B, GLU304A, GLU304B, GLU425A, GLU425B, GLU539A, GLU539B, GLY181A, GLY181B, GLY266A, GLY266B, GLY270A, GLY270B, GLY291A, GLY291B, GLY307A, GLY307B, GLY423A, GLY423B, GLY433A, GLY433B, GLY436A, GLY436B, GLY438A, GLY438B, GLY469A, GLY469B, GLY509A, GLY509B, GLY550A, GLY550B, GLY565A, GLY565B, GLY615A, GLY615B, GLY616A, GLY616B, GLY623A, GLY623B, HIS412A, HIS412B, HIS426A, HIS426B, HIS442A, HIS442B, HIS472A, HIS472B, HIS547A, HIS547B, HIS625A, HIS625B, HIS626A, HIS626B, ILE261A, ILE261B, ILE299A, ILE299B, ILE322A, ILE322B, ILE464A, ILE464B, ILE468A, ILE468B, LEU267A, LEU267B, LEU269A, LEU269B, LEU293A, LEU293B, LEU305A, LEU305B, LEU390A, LEU390B, LEU432A, LEU432B, LEU437A, LEU437B, LEU439A, LEU439B, LEU453A, LEU453B, LEU471A, LEU471B, LEU545A, LEU545B, LEU551A, LEU551B, LEU619A, LEU619B, LEU630A, LEU630B, LYS317A, LYS317B, LYS579A, LYS579B, LYS612A, LYS612B, LYS703A, LYS703B, MET473A, MET473B, MET566A, MET566B, MET570A, MET570B, MET621A, MET621B, PHE180A, PHE180B, PHE424A, PHE424B, PHE549A, PHE549B, PRO258A, PRO288B, PRO318A, PRO318B, PRO417A, PRO417B, PRO458A, PRO458B, PRO553A, PRO553B, PRO588A, PRO588B, PRO700A, PRO700B, PRO705A, SER298A, SER298B, SER300A, SER300B, SER323A, SER323B, SER420A, SER420B, SER422A, SER422B, SER429A, SER429B, SER454A, SER454B, SER456A, SER456B, SER457A, SER457B, SER476A, SER476B, SER506A, SER506B, SER508A, SER508B, SER542A, SER542B, SER584A, SER584B, SER628A, SER628B, THR268A, THR268B, THR278A, THR278B, THR416A, THR416B, THR441A, THR441B, THR443A, THR443B, THR466A, THR466B, THR543A, THR543B, THR569A, THR569B, THR609A, THR609B, THR610A, THR610B, THR613A, THR613B, THR622A, THR622B, TRP589A, TRP589B, TRP608A, TRP608B, TYR264A, TYR301A, TYR301B, TYR302A, TYR302B, TYR320A, TYR320B, TYR392A, TYR392B, TYR444A, TYR444B, TYR552A, TYR552B, TYR567A, TYR567B, TYR575A, TYR575B, TYR577A, TYR577B, TYR592A, TYR592B, VAL179A, VAL179B, VAL184A, VAL184B, VAL289A, VAL289B, VAL292A, VAL292B, VAL295A, VAL295B, VAL303A, VAL303B, VAL419A, VAL419B, VAL447A, VAL447B, VAL465A, VAL465B, VAL571A, VAL571B, VAL578A, VAL578B, VAL701A, VAL701B, VAL702A, VAL702B, VAL704A