3O4G

structure and catalysis of acylaminoacyl peptidase

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: B-C
  • Int. Res.: 75
  • Norm. En. per Res.: -2.7736
• 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	-70.5518	75.6793	-336.335	-331.2075	136	21	12	14650	1	44	55
A-D	-27.9304	-27.0371	-123.294	-178.2615	78	9	0	4897	9	44	38
B-C	-32.6984	-51.6425	-123.677	-208.018	75	7	0	4979	11	46	39
B-D	0.0	-2.3589	-4.6037	-6.9625	30	0	0	462	0	26	24
C-D	-73.784	73.6239	-309.074	-309.2341	133	9	13	13424	1	44	53

Interface residues

• A-B: ALA21A, ALA517A, ALA517B, ALA541A, ALA541B, ALA548A, ALA548B, ALA554A, ALA564A, ALA564B, ALA576A, ALA576B, ARG11A, ARG11B, ARG14A, ARG14B, ARG18A, ARG18B, ARG534A, ARG534B, ARG542A, ARG579B, ARG581B, ASN523A, ASN523B, ASP15A, ASP15B, ASP524A, ASP524B, ASP553A, ASP553B, ASP563A, ASP563B, GLN522A, GLN522B, GLN578A, GLN578B, GLU17A, GLU17B, GLU43B, GLU538A, GLU538B, GLU547A, GLU547B, GLU562A, GLU562B, GLU580A, GLU580B, GLU8A, GLU8B, GLY537A, GLY537B, GLY543A, GLY543B, HIS520A, HIS520B, HIS549A, HIS549B, ILE12A, ILE12B, ILE20A, ILE519A, ILE519B, ILE550A, ILE550B, ILE551A, ILE551B, LEU480A, LEU480B, LEU516A, LEU516B, LEU518A, LEU518B, LEU529A, LEU529B, LEU532A, LEU532B, LEU533A, LEU533B, LEU535A, LEU535B, LEU539A, LEU539B, LEU540A, LEU540B, LEU569A, LEU569B, LEU575B, LYS530A, LYS530B, LYS544A, LYS544B, LYS566A, LYS566B, LYS85A, MET536A, MET536B, MET561A, MET561B, PHE546A, PHE546B, PHE573A, PHE573B, PHE574A, PHE574B, PHE9A, PHE9B, PRO515A, PRO515B, PRO521A, PRO521B, PRO528A, PRO528B, PRO531A, PRO531B, PRO552A, PRO552B, PRO570A, PRO570B, PRO6A, SER10A, SER10B, THR545A, THR545B, THR560A, THR560B, THR577A, THR577B, VAL13A, VAL13B, VAL16A, VAL16B, VAL565A, VAL565B, VAL7A, VAL7B
• A-D: ALA270D, ALA280D, ARG14A, ARG18A, ARG258D, ARG277D, ARG292A, ARG307A, ARG327A, ARG327D, ARG328A, ASP239D, ASP256D, ASP274D, ASP325A, ASP52A, ASP52D, GLN282D, GLU23A, GLU276D, GLU279D, GLU315A, GLU315D, GLU319A, GLU324A, GLU324D, GLU55A, GLU55D, GLY275D, GLY293D, GLY314A, GLY314D, GLY320A, GLY321A, GLY53A, GLY53D, GLY54A, GLY54D, ILE273D, ILE308A, LEU254D, LEU290D, LEU295D, LEU311D, LEU317A, LEU317D, LEU318A, LEU322A, LEU326A, LEU36A, LYS238D, LYS294A, LYS294D, PHE272D, PRO236D, PRO312D, PRO316A, PRO316D, PRO323A, SER237D, SER242D, SER310A, SER310D, SER313A, SER313D, THR304A, THR56A, THR56D, TRP291A, TRP291D, TYR243D, TYR25A, TYR51A, TYR51D, VAL22A, VAL271D, VAL278D, VAL309A
• B-C: ALA270B, ALA280B, ARG14C, ARG18C, ARG258B, ARG277B, ARG292C, ARG307C, ARG327C, ARG328C, ASP239B, ASP256B, ASP325C, ASP52B, ASP52C, GLN282B, GLU23C, GLU276B, GLU279B, GLU315B, GLU315C, GLU319C, GLU324B, GLU324C, GLU55B, GLU55C, GLY275B, GLY293B, GLY314B, GLY314C, GLY320C, GLY321C, GLY53B, GLY53C, GLY54B, GLY54C, ILE273B, ILE308C, LEU254B, LEU290B, LEU295B, LEU311B, LEU317B, LEU317C, LEU318C, LEU322C, LEU326C, LYS238B, LYS294B, LYS294C, PHE272B, PRO236B, PRO312B, PRO316B, PRO316C, PRO323C, SER237B, SER242B, SER310B, SER310C, SER313B, SER313C, THR304C, THR56B, THR56C, TRP291B, TRP291C, TYR243B, TYR25C, TYR51B, TYR51C, VAL22C, VAL271B, VAL278B, VAL309C
• B-D: ALA331B, ARG11B, ARG11D, ARG14B, ARG14D, ARG18B, ARG18D, ARG328B, ARG328D, ARG355B, ARG355D, ASP15B, ASP15D, ASP325B, ASP325D, GLU324B, GLU324D, GLU8B, GLU8D, LEU326B, LEU326D, PRO323D, PRO357B, PRO357D, PRO6D, SER329B, THR358B, THR358D, VAL7B, VAL7D
• C-D: ALA21C, ALA517C, ALA517D, ALA541C, ALA541D, ALA548C, ALA548D, ALA554C, ALA564D, ALA576D, ARG11C, ARG11D, ARG14C, ARG14D, ARG18C, ARG18D, ARG534C, ARG534D, ARG542C, ARG579D, ARG581D, ASN523C, ASN523D, ASP15C, ASP15D, ASP524C, ASP524D, ASP553C, ASP553D, ASP563C, ASP563D, GLN522C, GLN522D, GLN578C, GLN578D, GLU17C, GLU17D, GLU43D, GLU538C, GLU538D, GLU547C, GLU547D, GLU562C, GLU562D, GLU580C, GLU580D, GLU8C, GLU8D, GLY537C, GLY537D, GLY543C, GLY543D, HIS520C, HIS520D, HIS549C, HIS549D, ILE12C, ILE12D, ILE519C, ILE519D, ILE550C, ILE550D, ILE551C, ILE551D, LEU480C, LEU480D, LEU516C, LEU516D, LEU518C, LEU518D, LEU529C, LEU529D, LEU532C, LEU532D, LEU533C, LEU533D, LEU535C, LEU535D, LEU539C, LEU539D, LEU540C, LEU540D, LEU569C, LEU569D, LEU575D, LYS530C, LYS530D, LYS544C, LYS544D, LYS566C, LYS566D, LYS85C, MET536C, MET536D, MET561C, MET561D, PHE546C, PHE546D, PHE573C, PHE573D, PHE574C, PHE574D, PHE9C, PHE9D, PRO515C, PRO515D, PRO521C, PRO521D, PRO528C, PRO528D, PRO531C, PRO531D, PRO552C, PRO552D, PRO570C, PRO570D, PRO6C, SER10C, SER10D, THR545C, THR545D, THR560C, THR560D, THR577C, THR577D, VAL13C, VAL13D, VAL16C, VAL16D, VAL565C, VAL565D, VAL7C, VAL7D