3R7K

crystal structure of a probable acyl coa dehydrogenase from mycobacterium abscessus atcc 19977 / dsm 44196

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 169
  • Norm. En. per Res.: -4.5328
• 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	-119.6287	-104.5689	-534.831	-759.0286	169	19	4	18439	6	77	68
A-C	-63.2325	-47.3586	-320.937	-431.5282	123	15	18	13367	2	41	45
A-D	0.0	1.8394	-58.9768	-57.1374	24	7	1	2178	0	6	15
B-C	-11.513	0.9952	-62.4583	-72.9761	23	7	1	2195	0	6	17
B-D	-23.8833	-8.6726	-284.214	-316.7699	115	6	17	11880	1	42	45
C-D	-105.024	-110.7032	-550.318	-766.0452	169	19	4	18538	9	77	66

Interface residues

• A-B: ALA151A, ALA151B, ALA156A, ALA156B, ALA354A, ALA354B, ARG159A, ARG159B, ARG217A, ARG217B, ARG225A, ARG225B, ARG288A, ARG288B, ARG293A, ARG293B, ARG298A, ARG298B, ARG365A, ARG365B, ARG371A, ARG371B, ARG374A, ARG374B, ARG377A, ARG377B, ASN157A, ASN157B, ASN341A, ASN352A, ASN352B, ASN386A, ASN386B, ASN390A, ASN390B, ASP154A, ASP154B, ASP220A, ASP220B, ASP348A, ASP348B, ASP375A, ASP375B, CYS376A, CYS376B, GLN356A, GLN356B, GLU148A, GLU148B, GLU231A, GLU289A, GLU289B, GLU353A, GLU353B, GLU366A, GLU366B, GLU370A, GLU370B, GLU387A, GLU387B, GLU391A, GLU391B, GLY104B, GLY150A, GLY150B, GLY152A, GLY152B, GLY223A, GLY223B, GLY292A, GLY292B, GLY359A, GLY359B, GLY360A, GLY360B, GLY362A, GLY362B, GLY380A, GLY380B, GLY382A, GLY382B, GLY384A, GLY384B, HIS372A, HIS372B, HIS53A, HIS53B, ILE300A, ILE300B, ILE301A, ILE301B, ILE357A, ILE357B, ILE369A, ILE369B, ILE378A, ILE378B, ILE381A, ILE381B, ILE388A, ILE388B, LEU219A, LEU219B, LEU295A, LEU295B, LEU379A, LEU379B, LYS221A, LYS221B, LYS304A, LYS304B, LYS340A, LYS340B, MET222A, MET222B, MET256A, MET361A, MET361B, MET364A, MET364B, MET389A, MET389B, PHE177A, PHE177B, PHE252A, PHE252B, PHE291A, PHE291B, PHE358A, PHE358B, PRO149A, PRO149B, SER153A, SER153B, SER227A, SER227B, SER367A, SER367B, THR103A, THR103B, THR147A, THR147B, THR176A, THR176B, THR229A, THR229B, THR290A, THR290B, THR385A, THR385B, TRP224A, TRP224B, TRP284A, TRP284B, TYR345A, TYR345B, TYR349A, TYR363A, TYR363B, TYR373A, TYR373B, VAL155A, VAL155B, VAL344A, VAL344B, VAL351A, VAL351B, VAL355A, VAL355B
• A-C: ALA285A, ALA306A, ALA306C, ALA309A, ALA309C, ALA315A, ALA315C, ALA321A, ALA321C, ALA328C, ALA334A, ALA334C, ALA339A, ALA339C, ALA343A, ALA343C, ALA346A, ALA346C, ALA394A, ALA394C, ARG286A, ARG286C, ARG298A, ARG302A, ARG302C, ARG310A, ARG310C, ARG320A, ARG320C, ARG325A, ARG325C, ARG396A, ARG396C, ASN341A, ASN341C, ASN386A, ASN386C, ASN390A, ASN390C, ASP313A, ASP313C, CYS316A, CYS316C, GLN299A, GLN299C, GLN311A, GLN311C, GLN324A, GLN324C, GLU22A, GLU307A, GLU307C, GLU330C, GLU335A, GLU335C, GLU387A, GLU387C, GLU391A, GLU391C, GLY297A, GLY398A, GLY398C, HIS303A, HIS303C, ILE301A, ILE301C, ILE388A, ILE388C, ILE393A, ILE393C, ILE397A, ILE397C, LEU278A, LEU278C, LEU295A, LEU305A, LEU305C, LEU399C, LYS282A, LYS282C, LYS304A, LYS304C, LYS340A, LYS340C, LYS395A, LYS395C, MET308A, MET308C, MET338A, MET338C, MET389A, MET389C, PRO21A, PRO294A, SER283A, SER337A, SER337C, THR296A, THR296C, THR317A, THR317C, THR319A, THR319C, THR342A, THR342C, THR385A, THR385C, TYR318A, TYR318C, TYR345A, TYR345C, TYR349C, VAL312A, VAL312C, VAL314A, VAL314C, VAL322A, VAL322C, VAL332A, VAL344A, VAL344C, VAL392A, VAL392C
• A-D: ALA306A, ARG293A, ARG293D, ARG298A, ARG298D, ARG302A, ARG302D, GLN299A, GLN299D, GLY297A, GLY297D, HIS303A, HIS303D, ILE300A, ILE300D, ILE301A, ILE301D, LEU295A, LEU295D, LYS304A, LYS304D, PHE291A, PHE291D, THR290D
• B-C: ARG293B, ARG293C, ARG298B, ARG298C, ARG302B, ARG302C, GLN299B, GLN299C, GLY297B, GLY297C, HIS303B, HIS303C, ILE300B, ILE300C, ILE301B, ILE301C, LEU295B, LEU295C, LYS304B, LYS304C, PHE291B, PHE291C, THR290C
• B-D: ALA306B, ALA306D, ALA309B, ALA309D, ALA315B, ALA315D, ALA321B, ALA321D, ALA334B, ALA334D, ALA339B, ALA339D, ALA343B, ALA343D, ALA346B, ALA346D, ALA394B, ALA394D, ARG286B, ARG286D, ARG302B, ARG302D, ARG310B, ARG310D, ARG320B, ARG320D, ARG325B, ARG325D, ARG396B, ARG396D, ASN341B, ASN341D, ASN386B, ASN386D, ASN390B, ASN390D, ASP313B, ASP313D, CYS316B, CYS316D, GLN299B, GLN299D, GLN311B, GLN311D, GLN324D, GLU22B, GLU307B, GLU307D, GLU330D, GLU335B, GLU335D, GLU387B, GLU387D, GLU391B, GLU391D, GLY398B, GLY398D, HIS303B, HIS303D, ILE301B, ILE301D, ILE388B, ILE388D, ILE393B, ILE393D, ILE397B, ILE397D, LEU278B, LEU278D, LEU305B, LEU305D, LYS282B, LYS282D, LYS304B, LYS304D, LYS340B, LYS340D, LYS395B, LYS395D, MET308B, MET308D, MET338B, MET338D, MET389B, MET389D, PRO21B, SER337B, SER337D, THR296B, THR296D, THR317B, THR317D, THR319B, THR319D, THR342B, THR342D, THR385B, THR385D, TYR318B, TYR318D, TYR345B, TYR345D, TYR349D, VAL312B, VAL312D, VAL314B, VAL314D, VAL322B, VAL322D, VAL332B, VAL332D, VAL344B, VAL344D, VAL392B, VAL392D
• C-D: ALA151C, ALA151D, ALA156C, ALA156D, ALA354C, ALA354D, ALA49D, ARG217C, ARG217D, ARG225C, ARG225D, ARG288C, ARG288D, ARG293C, ARG298C, ARG298D, ARG365C, ARG365D, ARG371C, ARG371D, ARG374C, ARG374D, ARG377C, ARG377D, ASN157C, ASN157D, ASN341C, ASN341D, ASN352C, ASN352D, ASN386C, ASN386D, ASN390C, ASN390D, ASP154C, ASP154D, ASP220C, ASP220D, ASP348C, ASP348D, ASP375C, ASP375D, CYS376C, CYS376D, GLN356C, GLN356D, GLU148C, GLU148D, GLU231C, GLU231D, GLU289C, GLU289D, GLU353C, GLU353D, GLU366C, GLU366D, GLU370C, GLU370D, GLU387C, GLU387D, GLU391C, GLU391D, GLY104C, GLY104D, GLY150C, GLY150D, GLY152C, GLY152D, GLY223C, GLY223D, GLY292C, GLY292D, GLY359C, GLY359D, GLY360C, GLY360D, GLY362C, GLY362D, GLY380C, GLY380D, GLY382C, GLY382D, GLY384C, GLY384D, HIS372C, HIS372D, HIS53C, HIS53D, ILE300C, ILE300D, ILE301C, ILE301D, ILE357C, ILE357D, ILE369C, ILE369D, ILE378C, ILE378D, ILE381C, ILE381D, ILE388C, ILE388D, LEU219C, LEU219D, LEU295C, LEU295D, LEU379C, LEU379D, LYS221C, LYS221D, LYS304C, LYS304D, LYS340C, LYS340D, MET222C, MET222D, MET361C, MET361D, MET364C, MET364D, MET389C, MET389D, PHE177C, PHE177D, PHE252C, PHE252D, PHE291C, PHE291D, PHE358C, PHE358D, PRO149C, PRO149D, SER153C, SER153D, SER227C, SER227D, SER367C, SER367D, THR103C, THR103D, THR147C, THR147D, THR176C, THR176D, THR229C, THR229D, THR290C, THR290D, THR385C, THR385D, TRP224C, TRP224D, TRP284C, TRP284D, TYR345C, TYR345D, TYR349D, TYR363C, TYR363D, TYR373C, TYR373D, VAL155C, VAL155D, VAL344C, VAL344D, VAL351C, VAL351D, VAL355C, VAL355D