3MR1

crystal structure of methionine aminopeptidase from rickettsia prowazekii

• Total interactions analyzed: 6
• Total true interactions: 4
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 67
  • Norm. En. per Res.: -2.6557
• 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	-31.7235	-15.3448	-110.043	-157.1113	69	9	0	5292	4	20	11
A-D	0.0	-10.4445	-65.6243	-76.0688	54	1	1	3363	0	20	28
B-D	0.0	11.0725	-19.6758	-8.6033	36	0	0	1287	0	17	22
C-D	-22.6969	-60.3389	-94.8928	-177.9286	67	1	1	4170	5	28	27

Interface residues

• A-B: ALA56A, ALA56B, ASN38A, ASN38B, ASN41A, ASN41B, ASN46A, ASN46B, ASN59A, ASN59B, ASN81A, ASN81B, ASP217A, ASP217B, ASP42A, ASP42B, ASP82A, ASP82B, GLY62A, GLY62B, HIS45A, HIS45B, ILE54A, ILE54B, ILE79A, ILE79B, ILE98A, ILE98B, LEU216A, LEU216B, LEU40A, LEU40B, LEU43A, LEU43B, LEU58A, LEU58B, LYS61B, LYS65A, LYS65B, LYS83A, LYS83B, PHE63A, PHE63B, PRO55A, PRO55B, PRO57A, PRO57B, PRO64A, PRO64B, PRO80A, PRO80B, SER39A, SER39B, SER50A, SER50B, SER66A, SER66B, THR36A, THR36B, THR37A, THR37B, THR49A, THR49B, TRP219A, TRP219B, TYR60A, TYR60B, VAL35A, VAL35B
• A-D: ALA56A, ALA56D, ARG172A, ARG172D, ASN59A, ASN59D, ASP100D, ASP176A, ASP176D, GLY101A, GLY101D, GLY171A, GLY171D, GLY62A, GLY62D, HIS175A, HIS175D, ILE2A, ILE2D, ILE4A, ILE4D, ILE54D, ILE98A, ILE98D, LEU58D, LEU99D, LYS12A, LYS177A, LYS177D, LYS193A, LYS3A, LYS3D, LYS61A, LYS61D, MET1A, MET1D, PHE174A, PHE174D, PHE63A, PHE63D, PRO57D, SER0A, SER0D, THR6A, TRP102A, TRP102D, TRP219A, TRP219D, TYR103A, TYR103D, TYR60A, TYR60D, VAL173A, VAL173D
• B-D: ALA141D, ARG138D, ARG172B, ASN59B, ASP100B, ASP176B, ASP241D, ASP9B, GLU194D, GLU7D, GLY101B, GLY140D, GLY62B, ILE4D, ILE54B, ILE98B, LEU192D, LYS12B, LYS142D, LYS193D, LYS240D, LYS3B, LYS61B, LYS8B, MET1B, PHE174B, PRO139D, SER0D, THR191D, THR239D, THR6D, TRP102B, TYR103B, TYR60B, VAL173B, VAL238D
• C-D: ALA154C, ALA206C, ALA20D, ALA21D, ARG108D, ARG121C, ARG163C, ARG185C, ASN158C, ASN186C, ASN208C, ASN87D, ASP114D, ASP128C, ASP128D, ASP25D, ASP29D, ASP89D, GLN124D, GLN151C, GLU135D, GLU155C, GLU22D, GLU244D, GLY113D, GLY17D, GLY207C, GLY88D, HIS157C, HIS234D, ILE117C, ILE123D, ILE134D, ILE245D, LEU248D, LEU24D, LYS118C, LYS120D, LYS132C, LYS156C, LYS18D, LYS32D, MET109D, MET130D, MET131D, PHE232D, PHE243D, PHE246D, PHE26D, PRO119C, PRO33D, SER152C, SER160C, THR106D, THR23D, THR247D, THR28D, TYR110D, TYR111D, TYR127D, TYR148C, TYR153C, TYR159C, VAL112D, VAL115D, VAL125C, VAL31D