2GPW

crystal structure of the biotin carboxylase subunit, f363a mutant, of acetyl-coa carboxylase from escherichia coli.

• Total interactions analyzed: 6
• Total true interactions: 4
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 142
  • Norm. En. per Res.: -3.1368
• Hub Node: B(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	-77.8931	-56.8307	-249.042	-383.7659	141	20	2	11603	11	69	57
B-C	0.0	0.0	-0.198	-0.198	6	0	0	52	0	1	2
B-D	-7.5668	-10.8309	-46.5257	-64.9234	43	7	1	2938	0	10	12
C-D	-89.0494	-94.651	-261.723	-445.4234	142	27	2	11776	13	68	58

Interface residues

• A-B: ALA20A, ALA20B, ALA359A, ALA359B, ALA363A, ALA363B, ALA373A, ALA373B, ALA398A, ALA398B, ALA400A, ALA400B, ALA405A, ALA405B, ARG16A, ARG16B, ARG19A, ARG19B, ARG314A, ARG314B, ARG331A, ARG331B, ARG356A, ARG356B, ARG366A, ARG366B, ARG401A, ARG401B, ASN394A, ASN394B, ASN404A, ASN404B, ASP307A, ASP307B, ASP396A, ASP396B, CYS21A, CYS21B, GLN407A, GLN407B, GLU23A, GLU23B, GLU301A, GLU301B, GLU311A, GLU311B, GLU327A, GLU327B, GLU368A, GLU368B, GLU393A, GLU393B, GLU408A, GLU408B, GLY25A, GLY25B, GLY305A, GLY305B, GLY361A, GLY361B, GLY362A, GLY362B, GLY364A, GLY364B, GLY374A, GLY374B, GLY392A, GLY392B, HIS297A, HIS297B, HIS329A, HIS329B, HIS358A, HIS358B, HIS370A, HIS370B, HIS41A, HIS41B, ILE309A, ILE309B, ILE323A, ILE323B, ILE371A, ILE371B, ILE389A, ILE389B, ILE399A, ILE399B, ILE410A, ILE410B, LEU15A, LEU15B, LEU18A, LEU18B, LEU24A, LEU24B, LEU308A, LEU308B, LEU406B, LEU409B, LEU43A, LEU43B, LEU44A, LEU44B, LYS22A, LYS22B, LYS310A, LYS310B, LYS403A, LYS403B, LYS40A, LYS40B, MET302A, MET302B, MET402A, MET402B, PHE357A, PHE357B, PRO298A, PRO298B, PRO360A, PRO360B, SER369A, SER369B, THR304A, THR304B, TRP367A, TRP367B, TYR372A, TYR372B, TYR375A, TYR375B, TYR391A, TYR391B, VAL306A, VAL306B, VAL330A, VAL365A, VAL365B, VAL397A, VAL397B
• B-C: ARG423C, ASP419C, LYS415C, LYS58B, PRO344C, PRO55B
• B-D: ALA30D, ALA45D, ARG234B, ARG235B, ARG37D, ASN345B, ASP343B, ASP36D, ASP38D, ASP46D, CYS50D, GLN447B, GLU47D, GLY413B, GLY52D, HIS32D, HIS41D, ILE414B, ILE51D, ILE72D, LEU348B, LEU39D, LEU43D, LEU444B, LEU446B, LEU44D, LYS353D, LYS40D, LYS415B, PHE347B, PRO344B, PRO349B, PRO351B, SER33D, SER34D, SER350B, THR346B, THR48D, THR73D, TYR372D, VAL29D, VAL42D, VAL49D
• C-D: ALA20C, ALA20D, ALA359C, ALA359D, ALA363C, ALA363D, ALA373C, ALA373D, ALA398C, ALA398D, ALA400C, ALA400D, ALA405C, ALA405D, ARG16C, ARG16D, ARG19C, ARG19D, ARG314C, ARG314D, ARG331C, ARG331D, ARG356C, ARG356D, ARG366C, ARG366D, ARG401C, ARG401D, ASN394C, ASN394D, ASN404C, ASN404D, ASP307C, ASP307D, ASP396C, ASP396D, CYS21C, CYS21D, CYS390D, GLN407C, GLN407D, GLU23C, GLU23D, GLU301C, GLU301D, GLU311C, GLU311D, GLU327C, GLU368C, GLU368D, GLU393C, GLU393D, GLU408C, GLU408D, GLY25C, GLY25D, GLY305C, GLY305D, GLY332D, GLY361C, GLY361D, GLY362C, GLY362D, GLY364C, GLY364D, GLY374C, GLY392C, GLY392D, HIS297C, HIS297D, HIS329C, HIS329D, HIS358C, HIS358D, HIS370C, HIS370D, HIS41C, HIS41D, ILE309C, ILE309D, ILE323C, ILE323D, ILE371C, ILE371D, ILE389C, ILE389D, ILE399C, ILE399D, ILE410C, ILE410D, LEU15C, LEU15D, LEU18C, LEU18D, LEU24C, LEU24D, LEU308C, LEU308D, LEU409C, LEU409D, LEU43C, LEU43D, LEU44C, LEU44D, LYS22C, LYS22D, LYS310C, LYS310D, LYS387C, LYS403C, LYS403D, LYS40C, LYS40D, MET302C, MET302D, MET402C, MET402D, PHE357C, PHE357D, PRO298C, PRO298D, PRO360C, PRO360D, SER369C, SER369D, THR304C, THR304D, THR355D, TRP367C, TRP367D, TYR372C, TYR372D, TYR375C, TYR375D, TYR391C, TYR391D, VAL306C, VAL306D, VAL365C, VAL365D, VAL397C, VAL397D