3CVD

regulation of protein function: crystal packing interfaces and conformational dimerization

• Total interactions analyzed: 3
• Total true interactions: 3
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 48
  • Norm. En. per Res.: -2.9629
• 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	0.0	-2.5362	-23.3943	-25.9305	46	10	1	2100	0	6	6
A-C	-38.9707	-19.9223	-83.3269	-142.2199	48	2	0	3200	2	20	19
B-C	0.0	0.0	-0.1049	-0.1049	17	0	0	47	0	0	3

Interface residues

• A-B: ALA19B, ALA90A, ALA90B, ALA95B, ARG93B, ASN33A, ASN34A, ASN40A, ASP10A, CYS89A, CYS89B, GLN15B, GLN63A, GLU70A, GLY69A, GLY94B, GLY96B, HIS39A, HIS61A, HIS92B, HIS9B, ILE41A, LEU13B, LEU42A, LEU64A, LYS30A, LYS35A, LYS6A, MET65A, MET7A, MET97B, PHE14B, PHE3A, PRO38A, PRO68A, PRO91A, SER62A, SER67A, SER71A, THR2A, THR4A, TRP31A, TYR88A, TYR88B, VAL32A, VAL98B
• A-C: ALA56A, ALA56C, ALA90C, ARG93C, ASN33A, ASN40C, ASP44C, ASP45C, ASP57A, ASP57C, GLN47C, GLN63A, GLU54C, GLU70A, GLU73A, GLY69A, HIS39A, HIS61A, HIS61C, ILE41A, ILE41C, ILE74A, LEU42A, LEU42C, LEU55A, LEU59A, LEU59C, LEU64A, LYS30A, LYS46C, LYS53C, LYS58A, MET65A, PHE43A, PHE43C, PHE66A, PRO38A, SER60A, SER60C, SER62A, SER62C, SER67A, SER71A, TRP31A, TYR72A, TYR87C, TYR88C, VAL32A
• B-C: ALA51B, ALA51C, ALA90C, ARG93C, GLN47B, GLN47C, GLY50C, HIS9B, LEU42C, LYS100B, LYS100C, LYS46B, LYS46C, SER62C, TYR88C, VAL98B, VAL98C