2VUN

the crystal structure of enamidase at 1.9 a resolution - a new member of the amidohydrolase superfamily

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 200
  • Norm. En. per Res.: -3.3914
• Hub Node: A(3)

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	-95.362	-6.674	-541.93	-643.966	201	23	2	21789	1	24	29
A-C	-22.4899	-20.3893	-236.611	-279.4901	85	8	6	9542	4	30	27
A-D	0.0	1.2263	-11.358	-10.1318	12	1	0	370	0	0	4
B-C	0.0	0.9493	-6.9588	-6.0096	10	2	0	290	0	0	4
B-D	-21.5363	-15.424	-238.877	-275.8373	85	7	6	9522	4	30	27
C-D	-118.2525	-22.4637	-537.57	-678.2861	200	19	2	21534	2	24	29

Interface residues

• A-B: ALA227A, ALA227B, ALA255A, ALA255B, ALA277A, ALA277B, ALA296A, ALA296B, ALA344A, ALA344B, ALA350A, ALA350B, ALA352A, ALA352B, ALA353A, ALA353B, ALA379A, ALA379B, ALA76A, ALA76B, ALA88A, ALA88B, ARG260A, ARG260B, ARG290A, ARG290B, ARG374A, ARG374B, ARG78A, ARG78B, ASN222A, ASN222B, ASN251A, ASN251B, ASN275A, ASN275B, ASN291A, ASN291B, ASN375A, ASN375B, ASP256A, ASP256B, ASP276A, ASP276B, ASP300A, ASP300B, ASP355A, ASP355B, ASP74A, ASP74B, ASP83A, ASP83B, CYS249A, CYS249B, CYS293A, CYS293B, GLN231A, GLN231B, GLN248A, GLN248B, GLN294A, GLN294B, GLN79A, GLN79B, GLU232A, GLU232B, GLY195A, GLY195B, GLY196A, GLY196B, GLY201A, GLY201B, GLY223A, GLY223B, GLY224A, GLY224B, GLY250A, GLY250B, GLY280A, GLY280B, GLY282A, GLY282B, GLY287A, GLY287B, GLY341A, GLY341B, GLY349A, GLY349B, GLY354A, GLY354B, GLY358B, GLY91A, GLY91B, HIS193A, HIS193B, HIS90A, HIS90B, ILE199A, ILE199B, ILE228A, ILE228B, ILE254A, ILE254B, ILE284A, ILE284B, ILE295A, ILE295B, ILE351A, ILE351B, ILE356A, ILE356B, LEU283A, LEU283B, LEU286A, LEU286B, LEU289A, LEU289B, LEU340A, LEU340B, LYS253A, LYS253B, LYS372A, LYS372B, LYS380A, LYS380B, LYS80A, LYS80B, MET292A, MET292B, MET298A, MET298B, MET82A, MET82B, PHE84A, PHE84B, PRO200A, PRO200B, PRO225A, PRO225B, PRO252A, PRO252B, PRO285A, PRO285B, PRO339A, PRO339B, PRO357A, PRO357B, PRO377A, PRO377B, PRO378A, PRO378B, PRO77A, PRO77B, SER198A, SER198B, SER202A, SER202B, SER203A, SER203B, SER229A, SER229B, SER279A, SER279B, SER297A, SER297B, SER299A, SER299B, SER342A, SER342B, SER373A, SER373B, SER86A, SER86B, SER87A, SER87B, THR197A, THR197B, THR204A, THR204B, THR226A, THR226B, THR281A, THR281B, THR338A, THR338B, THR376A, THR376B, THR81A, THR81B, TYR257A, TYR257B, TYR75A, TYR75B, VAL205A, VAL205B, VAL230A, VAL230B, VAL247A, VAL247B, VAL343A, VAL343B
• A-C: ALA111A, ALA111C, ALA112A, ALA112C, ALA116A, ALA116C, ALA118A, ALA118C, ALA128A, ALA128C, ALA76A, ALA76C, ARG107A, ARG107C, ARG129A, ARG129C, ASN127A, ASN127C, ASP110A, ASP110C, ASP74A, ASP74C, ASP83A, ASP83C, GLU153A, GLU153C, GLU157A, GLU157C, GLY106A, GLY106C, GLY113A, GLY113C, GLY72A, GLY72C, GLY73A, GLY73C, HIS103A, HIS103C, ILE119A, ILE119C, LEU117A, LEU117C, LEU121A, LEU121C, LYS109A, LYS109C, LYS115A, LYS115C, LYS123A, LYS123C, LYS156A, LYS156C, LYS80A, LYS80C, MET154A, MET82A, MET82C, PHE104A, PHE104C, PRO105A, PRO105C, PRO108A, PRO108C, PRO130A, PRO130C, PRO77A, PRO77C, SER122A, SER122C, SER124A, SER124C, SER71A, SER71C, THR114A, THR114C, THR120A, THR120C, THR81A, THR81C, TYR125A, TYR125C, TYR126A, TYR126C, TYR75A, TYR75C
• A-D: ALA76D, ASP74D, ASP83A, ASP83D, LYS80A, LYS80D, MET82A, MET82D, THR81A, THR81D, TYR75A, TYR75D
• B-C: ALA76C, ASP74C, ASP83B, ASP83C, LYS80B, LYS80C, MET82B, MET82C, THR81C, TYR75C
• B-D: ALA111B, ALA111D, ALA112B, ALA112D, ALA116B, ALA116D, ALA118B, ALA118D, ALA128B, ALA128D, ALA76B, ALA76D, ARG107B, ARG107D, ARG129B, ARG129D, ASN127B, ASN127D, ASP110B, ASP110D, ASP74B, ASP74D, ASP83B, ASP83D, GLU153B, GLU153D, GLU157B, GLU157D, GLY106B, GLY106D, GLY113B, GLY113D, GLY72B, GLY72D, GLY73B, GLY73D, HIS103B, HIS103D, ILE119B, ILE119D, LEU117B, LEU117D, LEU121B, LEU121D, LYS109B, LYS109D, LYS115B, LYS115D, LYS123B, LYS123D, LYS156B, LYS156D, LYS80B, LYS80D, MET154B, MET82B, MET82D, PHE104B, PHE104D, PRO105B, PRO105D, PRO108B, PRO108D, PRO130B, PRO130D, PRO77B, PRO77D, SER122B, SER122D, SER124B, SER124D, SER71B, SER71D, THR114B, THR114D, THR120B, THR120D, THR81B, THR81D, TYR125B, TYR125D, TYR126B, TYR126D, TYR75B, TYR75D
• C-D: ALA227C, ALA227D, ALA255C, ALA255D, ALA259D, ALA277C, ALA296C, ALA296D, ALA344C, ALA344D, ALA350C, ALA350D, ALA352C, ALA352D, ALA353C, ALA353D, ALA379C, ALA379D, ALA76C, ALA76D, ALA88C, ALA88D, ARG260C, ARG260D, ARG290C, ARG290D, ARG374C, ARG374D, ARG78C, ARG78D, ASN222C, ASN222D, ASN251C, ASN251D, ASN275C, ASN275D, ASN291C, ASN291D, ASN375C, ASN375D, ASP256C, ASP256D, ASP276C, ASP276D, ASP300C, ASP300D, ASP355C, ASP355D, ASP74C, ASP74D, ASP83C, ASP83D, CYS249C, CYS249D, CYS293C, CYS293D, GLN231C, GLN231D, GLN248C, GLN248D, GLN294C, GLN294D, GLN79C, GLN79D, GLU232C, GLU232D, GLY195C, GLY195D, GLY196C, GLY196D, GLY201C, GLY201D, GLY223C, GLY223D, GLY224C, GLY224D, GLY250C, GLY250D, GLY280C, GLY280D, GLY282C, GLY282D, GLY287C, GLY287D, GLY341C, GLY341D, GLY349C, GLY349D, GLY354C, GLY354D, GLY358C, GLY91C, GLY91D, HIS193C, HIS193D, HIS90C, HIS90D, ILE199C, ILE199D, ILE228C, ILE228D, ILE254C, ILE254D, ILE284C, ILE284D, ILE295C, ILE295D, ILE351C, ILE351D, ILE356C, ILE356D, LEU283C, LEU283D, LEU286C, LEU286D, LEU289C, LEU289D, LEU340C, LEU340D, LYS253C, LYS253D, LYS372C, LYS372D, LYS380C, LYS380D, LYS80C, LYS80D, MET292C, MET292D, MET298C, MET298D, MET82C, MET82D, PHE84C, PHE84D, PRO200C, PRO200D, PRO225C, PRO225D, PRO252C, PRO252D, PRO285C, PRO285D, PRO339C, PRO339D, PRO357C, PRO357D, PRO377C, PRO377D, PRO378C, PRO378D, PRO77C, SER198C, SER198D, SER202C, SER202D, SER203C, SER203D, SER229C, SER229D, SER279C, SER279D, SER297C, SER297D, SER299C, SER299D, SER342C, SER342D, SER373C, SER373D, SER86C, SER86D, SER87C, SER87D, THR197C, THR197D, THR204C, THR204D, THR226C, THR226D, THR281C, THR281D, THR338C, THR338D, THR376C, THR376D, THR81C, THR81D, TYR257C, TYR257D, TYR75C, TYR75D, VAL205C, VAL205D, VAL230C, VAL230D, VAL247C, VAL247D, VAL343C, VAL343D