3OFT

crystal structure of cytochrome p450 cyp101c1

• Total interactions analyzed: 3
• Total true interactions: 3
• Strongest Interaction:
  • Chains: B-C
  • Int. Res.: 75
  • Norm. En. per Res.: -1.4241
• 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	-10.9386	-6.0076	-15.7494	-32.6956	46	0	0	1154	0	20	20
A-C	-4.2027	0.0	-40.584	-44.7867	39	1	0	1904	0	9	8
B-C	-6.9245	-42.6986	-57.1846	-106.8077	75	8	0	3942	2	39	39

Interface residues

• A-B: ALA376A, ALA389A, ARG162B, ARG172A, ARG172B, ASN18A, ASP135A, ASP174A, ASP188B, ASP374A, ASP374B, GLN165B, GLN169B, GLN24A, GLU126B, GLU158B, GLU195B, GLU23A, GLY175A, GLY21A, GLY381A, LEU166B, LYS123B, LYS375A, LYS375B, LYS380A, MET177B, MET1A, MET379A, PHE17A, PRO130B, PRO161B, PRO173A, PRO192B, PRO20A, SER127B, SER138A, SER138B, SER176A, THR178A, THR378A, THR388A, TRP191B, VAL168B, VAL22A, VAL377A
• A-C: ALA106C, ALA185A, ARG108C, ARG162A, ARG208C, ARG217C, ASP174A, ASP188A, ASP203C, GLN165A, GLN169A, GLN181A, GLN184A, GLU180A, GLU212C, GLY104C, GLY167A, GLY175A, GLY215C, GLY216C, LEU163A, LEU166A, LEU182A, LYS103C, LYS95C, MET102C, MET177A, PHE109C, PRO192A, PRO213C, PRO218C, SER107C, SER176A, SER211C, THR178A, THR99C, TRP191A, VAL179A, VAL214C
• B-C: ALA112B, ALA112C, ALA119B, ALA119C, ALA121B, ALA199C, ALA396B, ARG108C, ARG122B, ARG122C, ARG129B, ARG160B, ARG197C, ARG208C, ARG258B, ARG261B, ARG263B, ARG360B, ASP154B, ASP154C, ASP159C, ASP203C, ASP204C, ASP265B, GLN118B, GLN200C, GLU114B, GLU114C, GLU126B, GLU126C, GLU158B, GLU158C, GLU262B, GLU361B, GLY202C, GLY364B, GLY365B, ILE153C, ILE267B, ILE356B, LEU113C, LEU124B, LEU157B, LEU157C, LEU363B, LYS116B, LYS116C, LYS123B, LYS123C, LYS196C, MET125B, MET198C, MET366B, PHE109C, PRO115B, PRO115C, PRO130B, PRO156B, PRO156C, PRO201C, PRO264B, PRO268B, PRO367B, SER127B, SER207C, SER211C, THR151B, THR151C, VAL111B, VAL111C, VAL117C, VAL120B, VAL155B, VAL155C, VAL357B