3AMJ

the crystal structure of the heterodimer of m16b peptidase from sphingomonas sp. a1

• Total interactions analyzed: 6
• Total true interactions: 3
• Strongest Interaction:
  • Chains: B-A
  • Int. Res.: 242
  • Norm. En. per Res.: -3.4947
• Hub Node: C(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
B-A	-134.0048	-100.1896	-611.533	-845.7274	242	44	11	25394	8	103	90
C-D	-54.0828	-71.9912	-333.088	-459.162	162	13	6	13913	8	61	51
C-A	-111.0409	-29.1225	-308.945	-449.1084	147	18	6	12682	7	33	24

Interface residues

• B-A: ALA100A, ALA101A, ALA108A, ALA141B, ALA149B, ALA151B, ALA153B, ALA155A, ALA158B, ALA21B, ALA257B, ALA260B, ALA263B, ALA266A, ALA268A, ALA307A, ALA320A, ALA323A, ALA333B, ALA339B, ALA358B, ALA362B, ALA363B, ALA372A, ALA372B, ALA379B, ALA383A, ALA52A, ALA76B, ALA89B, ALA91B, ALA95B, ALA99B, ARG100B, ARG105A, ARG115B, ARG125A, ARG146B, ARG148B, ARG150B, ARG156B, ARG158A, ARG159A, ARG161A, ARG167A, ARG303B, ARG306B, ARG311A, ARG315A, ARG332B, ARG374B, ARG376A, ARG41B, ARG51A, ARG93B, ARG98A, ASN107A, ASN258B, ASN317A, ASN366B, ASN369B, ASN378B, ASN40B, ASN88B, ASP106A, ASP163A, ASP164A, ASP304B, ASP305A, ASP365B, ASP376B, ASP390A, ASP47B, ASP49A, ASP75B, ASP92B, ASP96B, GLN119A, GLN120A, GLN152A, GLN159B, GLN161B, GLN190B, GLN196A, GLN262B, GLN312A, GLN361B, GLN380A, GLN384B, GLN389A, GLN395A, GLU122B, GLU145B, GLU147B, GLU150A, GLU156A, GLU157A, GLU157B, GLU269A, GLU295B, GLU330B, GLU334B, GLU359B, GLU371A, GLU373A, GLU388A, GLU80A, GLU87B, GLU94A, GLY103A, GLY104A, GLY154B, GLY163B, GLY216B, GLY292B, GLY293B, GLY303A, GLY306A, GLY307B, GLY311B, GLY316A, GLY370B, GLY384A, GLY93A, GLY98B, HIS264B, HIS50A, HIS77A, HIS81A, ILE151A, ILE152B, ILE154A, ILE165B, ILE189A, ILE22B, ILE302B, ILE368B, ILE381B, ILE90B, ILE97B, LEU101B, LEU114B, LEU117B, LEU146A, LEU155B, LEU270A, LEU308B, LEU313A, LEU367B, LEU373B, LEU375B, LEU382B, LEU392A, LEU43B, LEU445A, LEU448A, LEU46B, LEU55A, LEU73B, LEU94B, LYS148A, LYS149A, LYS165A, LYS169A, LYS300B, LYS305B, LYS318A, LYS335B, LYS346A, LYS364B, LYS380B, LYS385A, LYS85A, LYS97A, MET102A, MET192A, MET299B, MET381A, MET393A, MET45B, PHE109A, PHE294B, PHE371B, PHE84A, PHE95A, PRO122A, PRO142B, PRO162B, PRO166A, PRO259B, PRO267A, PRO271A, PRO29A, PRO344A, PRO447A, PRO449A, PRO44B, PRO450A, PRO53A, PRO92A, SER118B, SER119B, SER123A, SER124A, SER309B, SER322A, SER345A, SER375A, SER377B, SER379A, SER391A, SER72B, SER96A, THR160B, THR261B, THR310A, THR331B, THR42B, THR54A, TRP160A, TYR118A, TYR272A, TYR287B, TYR304A, TYR310B, TYR313B, TYR387A, VAL116B, VAL121A, VAL143B, VAL153A, VAL186B, VAL215B, VAL314A, VAL321A, VAL343A, VAL377A, VAL382A, VAL386A, VAL38B, VAL56A, VAL99A
• C-D: ALA100C, ALA101C, ALA126D, ALA149D, ALA153D, ALA21D, ALA307C, ALA362D, ALA372C, ALA372D, ALA379D, ALA383C, ALA52C, ALA76D, ALA89D, ALA91D, ALA95D, ALA99D, ARG100D, ARG105C, ARG115D, ARG125C, ARG146D, ARG150D, ARG156D, ARG161C, ARG303D, ARG311C, ARG315C, ARG332D, ARG374D, ARG376C, ARG51C, ARG93D, ARG98C, ASN107C, ASN366D, ASN369D, ASN378D, ASN40D, ASN88D, ASP106C, ASP217D, ASP304D, ASP305C, ASP365D, ASP376D, ASP390C, ASP47D, ASP49C, ASP75D, ASP86D, ASP92D, ASP96D, GLN119C, GLN120C, GLN161D, GLN262D, GLN312C, GLN380C, GLN389C, GLN395C, GLU122D, GLU147D, GLU150C, GLU156C, GLU157D, GLU269C, GLU295D, GLU373C, GLU388C, GLU39D, GLU87D, GLU94C, GLY103C, GLY104C, GLY154D, GLY216D, GLY292D, GLY293D, GLY303C, GLY306C, GLY316C, GLY370D, GLY384C, GLY93C, GLY98D, HIS50C, ILE152D, ILE22D, ILE368D, ILE381D, ILE90D, ILE97D, LEU114D, LEU117D, LEU270C, LEU367D, LEU373D, LEU375D, LEU382D, LEU392C, LEU43D, LEU46D, LEU55C, LEU94D, LYS149C, LYS300D, LYS318C, LYS346C, LYS378C, LYS380D, LYS385C, LYS85C, LYS97C, MET102C, MET299D, MET381C, MET393C, MET45D, PHE294D, PHE371D, PRO122C, PRO142D, PRO29C, PRO44D, PRO450C, PRO53C, SER118D, SER119D, SER123C, SER124C, SER296D, SER32C, SER375C, SER377D, SER379C, SER391C, SER96C, THR160D, THR261D, THR310C, THR42D, THR54C, TRP160C, TYR287D, TYR304C, TYR310D, TYR387C, VAL116D, VAL121C, VAL143D, VAL153C, VAL215D, VAL314C, VAL321C, VAL377C, VAL382C, VAL386C, VAL38D, VAL56C, VAL99C
• C-A: ALA173A, ALA173C, ALA176A, ALA176C, ALA177A, ALA177C, ALA181A, ALA181C, ALA200C, ALA247A, ALA247C, ALA257A, ALA257C, ALA266A, ALA266C, ALA443C, ARG158A, ARG158C, ARG185A, ARG185C, ARG209A, ARG209C, ARG248A, ARG248C, ARG260A, ARG260C, ARG261A, ARG261C, ASN193A, ASN193C, ASN197A, ASN197C, ASN444A, ASN444C, ASP163A, ASP194A, ASP194C, ASP202A, ASP202C, ASP205A, ASP437A, ASP437C, ASP438A, ASP438C, ASP67A, ASP67C, GLN196A, GLN196C, GLN201A, GLN201C, GLN250A, GLN250C, GLN251A, GLN251C, GLN255A, GLN255C, GLN256A, GLN256C, GLN335C, GLU172A, GLU172C, GLU253A, GLU253C, GLU68A, GLU68C, GLY252A, GLY252C, GLY258A, GLY258C, GLY71A, GLY71C, HIS182A, HIS182C, ILE195C, LEU440A, LEU440C, LEU445A, LEU445C, LEU448A, LEU448C, LYS169A, LYS169C, LYS249A, LYS249C, LYS265A, LYS265C, MET175A, MET175C, MET192A, MET192C, MET198A, MET198C, MET66A, MET66C, PHE147A, PHE147C, PRO183A, PRO183C, PRO187A, PRO187C, PRO254A, PRO254C, PRO267A, SER178A, SER178C, SER65A, THR199A, THR199C, THR263A, THR263C, THR436A, THR436C, THR439C, THR441A, THR441C, THR69A, THR69C, THR70A, THR70C, THR72A, THR72C, THR73A, THR73C, TRP191A, TRP191C, TRP206A, TRP206C, TYR179A, TYR179C, TYR184A, TYR184C, VAL180A, VAL180C, VAL186A, VAL186C, VAL259A, VAL259C, VAL262A, VAL262C, VAL264A, VAL264C, VAL442A, VAL442C, VAL446A, VAL446C, VAL75A, VAL75C