3H8F

high ph native structure of leucine aminopeptidase from pseudomonas putida

• Total interactions analyzed: 15
• Total true interactions: 12
• Strongest Interaction:
  • Chains: B-F
  • Int. Res.: 111
  • Norm. En. per Res.: -4.5982
• Hub Node: A(4)

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-C	-39.0727	-117.2901	-318.029	-474.3918	112	10	8	11963	7	43	19
A-D	-51.6889	-24.675	-286.539	-362.9029	105	10	5	11312	3	26	21
A-E	-54.0923	-62.4533	-122.146	-238.6916	74	10	1	4812	4	14	14
A-F	-46.976	-7.0012	-279.66	-333.6372	105	10	5	10940	0	24	21
B-C	-80.3684	-12.7846	-284.451	-377.604	106	13	5	11020	1	24	21
B-D	-78.9103	-53.2715	-136.053	-268.2348	68	12	0	5004	7	14	15
B-E	-47.6821	-16.4579	-279.334	-343.474	107	10	5	11181	1	24	21
B-F	-42.6106	-129.8076	-337.984	-510.4022	111	17	9	12284	7	42	17
C-E	-73.7509	-22.4846	-284.398	-380.6335	106	18	5	11112	1	25	21
C-F	-52.7132	-48.8841	-133.996	-235.5933	73	8	1	4895	4	15	16
D-E	-39.4139	-108.7856	-323.733	-471.9325	106	10	8	11695	7	40	17
D-F	-57.908	-14.3687	-283.264	-355.5407	111	9	5	10950	2	23	21

Interface residues

• A-C: ALA380A, ALA380C, ALA384A, ALA384C, ALA414A, ALA414C, ALA442A, ALA442C, ALA466A, ALA466C, ARG413A, ARG413C, ARG482A, ARG482C, ARG87A, ARG87C, ASP397A, ASP397C, ASP411A, ASP411C, ASP421A, ASP421C, ASP86A, ASP86C, CYS381A, CYS381C, GLN416A, GLN416C, GLN424A, GLN424C, GLN426A, GLN426C, GLU286A, GLU286C, GLU422A, GLU422C, GLU425A, GLU425C, GLY379A, GLY379C, GLY386A, GLY386C, GLY439A, GLY439C, GLY443A, GLY443C, GLY467A, GLY467C, GLY473A, GLY473C, GLY85A, GLY85C, HIS388A, HIS388C, ILE382A, ILE382C, ILE445A, ILE445C, ILE471A, ILE471C, LEU385A, LEU385C, LEU392A, LEU392C, LEU404A, LEU404C, LEU417A, LEU417C, LEU419A, LEU419C, LYS408A, LYS408C, LYS441A, LYS441C, LYS91A, LYS91C, MET393A, MET393C, PHE420A, PHE420C, PRO418A, PRO418C, PRO440A, PRO440C, SER387A, SER387C, SER472A, SER472C, THR378A, THR378C, THR389A, THR389C, THR390A, THR390C, THR444A, THR444C, THR446A, THR446C, THR468A, THR468C, THR88A, THR88C, TRP415A, TRP415C, TRP470A, TRP470C, TYR423A, TYR423C, VAL383A, VAL383C, VAL400A, VAL400C
• A-D: ALA236D, ALA282A, ALA328A, ALA328D, ALA432D, ALA479A, ARG143A, ARG187A, ARG330D, ASN191A, ASN195A, ASN322A, ASN347D, ASP142A, ASP242A, ASP272A, ASP285A, ASP333D, ASP349D, ASP428D, ASP433D, ASP476A, CYS197A, GLN147A, GLN239A, GLN239D, GLN243A, GLN341D, GLU286A, GLU321A, GLU344D, GLU425D, GLY190A, GLY232D, GLY240A, GLY240D, GLY274A, GLY275A, GLY275D, GLY281A, GLY283A, GLY326A, GLY326D, GLY327A, GLY327D, GLY332D, GLY340D, GLY435D, GLY473A, GLY474A, GLY478A, HIS198A, ILE276A, ILE276D, ILE334D, ILE345D, ILE437D, ILE471A, LEU192A, LEU196A, LEU278A, LEU278D, LEU346D, LEU427D, LYS145A, LYS279A, LYS279D, LYS288A, LYS475A, LYS477A, MET284A, MET287A, MET323A, MET323D, MET434D, PHE141A, PHE144A, PHE271A, PHE431D, PRO193A, PRO194A, PRO280A, PRO324A, PRO324D, PRO331D, PRO430D, SER146A, SER241A, SER277D, SER325A, SER325D, SER429D, SER472A, THR270A, THR273A, THR329D, THR336D, THR342D, THR348D, TRP470A, TYR139A, TYR289A, VAL140A, VAL335D, VAL343D
• A-E: ALA153A, ALA153E, ALA16A, ALA16E, ALA42A, ALA42E, ALA45A, ALA45E, ALA53A, ALA53E, ALA70A, ALA70E, ARG26A, ARG26E, ARG49A, ARG49E, ARG72A, ARG72E, ASN104A, ASN104E, ASN64A, ASN64E, ASP51A, ASP51E, GLN147A, GLN147E, GLN58A, GLN58E, GLN63A, GLN63E, GLU150A, GLU71A, GLU71E, GLY102A, GLY102E, GLY105A, GLY105E, GLY50A, GLY50E, ILE43A, ILE43E, LEU103A, LEU103E, LEU47A, LEU47E, LEU52A, LEU52E, LEU60A, LEU60E, LEU61A, LEU61E, LEU62A, LEU62E, LEU65A, LEU65E, LEU75E, LYS475E, LYS48A, LYS48E, LYS55A, LYS55E, LYS80E, LYS91A, THR17A, THR17E, THR59A, THR59E, VAL149A, VAL46A, VAL46E, VAL73A, VAL73E, VAL99A, VAL99E
• A-F: ALA236A, ALA282F, ALA328A, ALA328F, ALA432A, ALA479F, ARG143F, ARG187F, ARG330A, ASN191F, ASN195F, ASN322F, ASN347A, ASP142F, ASP188F, ASP242F, ASP272F, ASP285F, ASP333A, ASP349A, ASP428A, ASP433A, ASP476F, CYS197F, GLN147F, GLN239A, GLN239F, GLN243F, GLN341A, GLU286F, GLU321F, GLU344A, GLY190F, GLY232A, GLY240A, GLY240F, GLY274F, GLY275A, GLY275F, GLY281F, GLY283F, GLY326A, GLY326F, GLY327A, GLY327F, GLY332A, GLY340A, GLY473F, GLY474F, GLY478F, HIS198F, ILE276A, ILE276F, ILE334A, ILE345A, ILE437A, ILE471F, LEU192F, LEU196F, LEU278A, LEU278F, LEU346A, LYS145F, LYS148F, LYS279A, LYS279F, LYS288F, LYS475F, LYS477F, MET284F, MET287F, MET323A, MET323F, MET434A, PHE141F, PHE144F, PHE271F, PHE431A, PRO193F, PRO194F, PRO280F, PRO324A, PRO324F, PRO331A, PRO430A, SER146F, SER241F, SER277A, SER325A, SER325F, SER339A, SER429A, SER472F, THR270F, THR273F, THR329A, THR336A, THR337A, THR342A, THR348A, TRP470F, TYR139F, TYR289F, VAL335A, VAL343A
• B-C: ALA236B, ALA282C, ALA328B, ALA328C, ALA432B, ALA479C, ARG143C, ARG187C, ARG330B, ASN191C, ASN195C, ASN322C, ASN347B, ASP142C, ASP242C, ASP272C, ASP285C, ASP333B, ASP428B, ASP433B, ASP476C, CYS197C, GLN147C, GLN239B, GLN239C, GLN243C, GLN341B, GLU286C, GLU321C, GLU344B, GLY190C, GLY232B, GLY240B, GLY240C, GLY274C, GLY275B, GLY275C, GLY281C, GLY283C, GLY326B, GLY326C, GLY327B, GLY327C, GLY332B, GLY340B, GLY435B, GLY473C, GLY474C, GLY478C, HIS198C, ILE276B, ILE276C, ILE334B, ILE345B, ILE437B, ILE471C, LEU192C, LEU196C, LEU278B, LEU278C, LEU346B, LEU427B, LYS145C, LYS279B, LYS279C, LYS288C, LYS475C, LYS477C, MET284C, MET287C, MET323B, MET323C, MET434B, PHE141C, PHE144C, PHE271C, PHE431B, PRO193C, PRO194C, PRO199C, PRO280C, PRO324B, PRO324C, PRO331B, PRO430B, SER146C, SER241C, SER277B, SER325B, SER325C, SER339B, SER429B, SER472C, THR270C, THR273C, THR329B, THR336B, THR337B, THR342B, THR348B, TRP470C, TYR139C, TYR289C, VAL140C, VAL335B, VAL343B
• B-D: ALA153D, ALA16B, ALA16D, ALA42B, ALA42D, ALA45B, ALA45D, ALA53B, ALA53D, ALA70B, ALA70D, ARG26B, ARG26D, ARG49B, ARG49D, ARG72B, ARG72D, ASN104B, ASN104D, ASN64B, ASN64D, ASP51B, ASP51D, GLN147B, GLN58B, GLN58D, GLN63B, GLN63D, GLU150B, GLU150D, GLU24B, GLU71B, GLU71D, GLY102B, GLY102D, GLY105B, GLY105D, GLY50B, GLY50D, ILE43B, LEU103B, LEU103D, LEU47B, LEU47D, LEU52B, LEU52D, LEU60B, LEU60D, LEU61B, LEU61D, LEU62B, LEU62D, LEU65B, LEU65D, LEU75B, LEU75D, LYS48B, LYS48D, LYS55B, LYS55D, THR17B, THR17D, THR59B, THR59D, VAL46B, VAL46D, VAL73B, VAL73D
• B-E: ALA236E, ALA282B, ALA328B, ALA328E, ALA432E, ALA479B, ARG143B, ARG187B, ARG330E, ASN191B, ASN195B, ASN322B, ASN347E, ASP142B, ASP188B, ASP242B, ASP272B, ASP285B, ASP333E, ASP349E, ASP428E, ASP433E, ASP476B, CYS197B, GLN147B, GLN239B, GLN239E, GLN243B, GLN341E, GLU286B, GLU321B, GLU344E, GLY190B, GLY232E, GLY240B, GLY240E, GLY274B, GLY275B, GLY275E, GLY281B, GLY283B, GLY326B, GLY326E, GLY327B, GLY327E, GLY332E, GLY340E, GLY435E, GLY473B, GLY474B, GLY478B, HIS198B, ILE276B, ILE276E, ILE334E, ILE345E, ILE437E, ILE471B, LEU192B, LEU196B, LEU278B, LEU278E, LEU346E, LEU427E, LYS145B, LYS279B, LYS279E, LYS288B, LYS475B, LYS477B, MET284B, MET287B, MET323B, MET323E, MET434E, PHE141B, PHE144B, PHE271B, PHE431E, PRO193B, PRO194B, PRO199B, PRO280B, PRO324B, PRO324E, PRO331E, PRO430E, SER146B, SER241B, SER277E, SER325B, SER325E, SER339E, SER429E, SER472B, THR270B, THR273B, THR329E, THR336E, THR342E, THR348E, TRP470B, TYR139B, TYR289B, VAL140B, VAL335E, VAL343E
• B-F: ALA380B, ALA380F, ALA384B, ALA384F, ALA414B, ALA414F, ALA442B, ALA442F, ALA466B, ALA466F, ARG413B, ARG413F, ARG482B, ARG482F, ARG87B, ARG87F, ASP397B, ASP397F, ASP411B, ASP411F, ASP421B, ASP421F, ASP86B, ASP86F, CYS381B, CYS381F, GLN416B, GLN416F, GLN424B, GLN424F, GLN426B, GLN426F, GLU286B, GLU286F, GLU422B, GLU422F, GLU425B, GLU425F, GLY379B, GLY379F, GLY386B, GLY386F, GLY394B, GLY439B, GLY439F, GLY443B, GLY443F, GLY467B, GLY467F, GLY473B, GLY473F, HIS388B, HIS388F, ILE382B, ILE382F, ILE445B, ILE445F, ILE471B, ILE471F, LEU385B, LEU385F, LEU392B, LEU392F, LEU404B, LEU404F, LEU417B, LEU417F, LEU419B, LEU419F, LYS408B, LYS408F, LYS441B, LYS441F, LYS91B, LYS91F, MET393B, MET393F, PHE420B, PHE420F, PRO418B, PRO418F, PRO440B, PRO440F, SER387B, SER387F, SER472B, SER472F, THR378B, THR378F, THR389B, THR389F, THR390B, THR390F, THR444B, THR444F, THR446B, THR446F, THR468B, THR468F, THR88B, THR88F, TRP415B, TRP415F, TRP470B, TRP470F, TYR423B, TYR423F, VAL383B, VAL383F, VAL400B, VAL400F
• C-E: ALA236C, ALA282E, ALA328C, ALA328E, ALA432C, ALA479E, ARG143E, ARG187E, ARG330C, ASN191E, ASN195E, ASN322E, ASN347C, ASP142E, ASP188E, ASP242E, ASP272E, ASP285E, ASP333C, ASP349C, ASP428C, ASP433C, ASP476E, CYS197E, GLN147E, GLN239C, GLN239E, GLN243E, GLN341C, GLU286E, GLU321E, GLU344C, GLU425C, GLY190E, GLY232C, GLY240C, GLY240E, GLY274E, GLY275C, GLY275E, GLY281E, GLY283E, GLY326C, GLY326E, GLY327C, GLY327E, GLY332C, GLY340C, GLY473E, GLY474E, GLY478E, HIS198E, ILE276C, ILE276E, ILE334C, ILE345C, ILE437C, ILE471E, LEU192E, LEU196E, LEU278C, LEU278E, LEU346C, LYS145E, LYS148E, LYS279C, LYS279E, LYS288E, LYS475E, LYS477E, MET284E, MET287E, MET323C, MET323E, MET434C, PHE141E, PHE144E, PHE271E, PHE431C, PRO193E, PRO194E, PRO280E, PRO324C, PRO324E, PRO331C, PRO430C, SER146E, SER241E, SER277C, SER325C, SER325E, SER339C, SER429C, SER472E, THR270E, THR273E, THR329C, THR336C, THR337C, THR342C, THR348C, TRP470E, TYR139E, TYR289E, VAL335C, VAL343C
• C-F: ALA153C, ALA153F, ALA16C, ALA16F, ALA42C, ALA42F, ALA45C, ALA45F, ALA53C, ALA53F, ALA70C, ALA70F, ARG26F, ARG49C, ARG49F, ARG72C, ARG72F, ASN104C, ASN104F, ASN64C, ASN64F, ASP51C, ASP51F, GLN58C, GLN58F, GLN63C, GLN63F, GLN66C, GLN66F, GLU150C, GLU150F, GLU71C, GLU71F, GLY102C, GLY102F, GLY105C, GLY105F, GLY50C, GLY50F, ILE43C, ILE43F, LEU103C, LEU103F, LEU47C, LEU47F, LEU52C, LEU52F, LEU60C, LEU60F, LEU61C, LEU61F, LEU62C, LEU62F, LEU65C, LEU65F, LEU75C, LEU75F, LYS475C, LYS475F, LYS48C, LYS48F, LYS55C, LYS55F, THR17C, THR17F, THR59C, THR59F, VAL149F, VAL46C, VAL46F, VAL73C, VAL73F, VAL99F
• D-E: ALA380D, ALA380E, ALA384D, ALA384E, ALA414D, ALA414E, ALA442D, ALA442E, ARG413D, ARG413E, ARG482D, ARG482E, ARG87D, ARG87E, ASP397D, ASP397E, ASP411D, ASP411E, ASP421D, ASP421E, ASP86D, ASP86E, CYS381D, CYS381E, GLN416D, GLN416E, GLN424D, GLN424E, GLN426D, GLN426E, GLU422D, GLU422E, GLU425D, GLU425E, GLY379D, GLY379E, GLY386D, GLY386E, GLY394E, GLY439D, GLY439E, GLY443D, GLY443E, GLY467D, GLY467E, GLY473D, GLY85E, HIS388D, HIS388E, ILE382D, ILE382E, ILE445D, ILE445E, ILE471D, ILE471E, LEU385D, LEU385E, LEU392D, LEU392E, LEU404D, LEU404E, LEU417D, LEU417E, LEU419D, LEU419E, LYS408D, LYS408E, LYS441D, LYS441E, LYS91D, LYS91E, MET393D, MET393E, PHE420D, PHE420E, PRO418D, PRO418E, PRO440D, PRO440E, SER387D, SER387E, SER472D, SER472E, THR378D, THR378E, THR389D, THR389E, THR390D, THR390E, THR444D, THR444E, THR446D, THR446E, THR468D, THR468E, THR88D, THR88E, TRP415D, TRP415E, TRP470E, TYR423D, TYR423E, VAL383D, VAL383E, VAL400D, VAL400E
• D-F: ALA236F, ALA282D, ALA328D, ALA328F, ALA432F, ALA479D, ARG143D, ARG187D, ARG330F, ARG453F, ASN191D, ASN195D, ASN322D, ASN347F, ASP142D, ASP188D, ASP242D, ASP272D, ASP285D, ASP333F, ASP349F, ASP428F, ASP433F, ASP476D, CYS197D, GLN147D, GLN239D, GLN239F, GLN243D, GLN341F, GLU286D, GLU321D, GLU344F, GLU425F, GLY190D, GLY232F, GLY240D, GLY240F, GLY274D, GLY275D, GLY275F, GLY281D, GLY283D, GLY326D, GLY326F, GLY327D, GLY327F, GLY332F, GLY340F, GLY435F, GLY473D, GLY474D, GLY478D, HIS198D, ILE276D, ILE276F, ILE334F, ILE345F, ILE437F, ILE471D, LEU192D, LEU196D, LEU278D, LEU278F, LEU346F, LEU427F, LYS145D, LYS279D, LYS279F, LYS288D, LYS456F, LYS475D, LYS477D, MET284D, MET287D, MET323D, MET323F, MET434F, PHE141D, PHE144D, PHE271D, PHE431F, PRO193D, PRO194D, PRO199D, PRO280D, PRO280F, PRO324D, PRO324F, PRO331F, PRO430F, SER146D, SER241D, SER277F, SER325D, SER325F, SER339F, SER429F, SER472D, THR270D, THR273D, THR329F, THR336F, THR337F, THR342F, THR348F, TRP470D, TYR139D, TYR289D, VAL335F, VAL343F