1OY3

crystal structure of an ikbbeta/nf-kb p65 homodimer complex

• Total interactions analyzed: 3
• Total true interactions: 3
• Strongest Interaction:
  • Chains: C-B
  • Int. Res.: 62
  • Norm. En. per Res.: -4.8869
• Hub Node: C(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
C-B	-38.3444	-88.4105	-176.234	-302.9889	62	19	5	7154	8	14	26
C-D	-34.5018	-66.8699	-294.057	-395.4287	119	24	10	12622	6	59	63
B-D	-20.2141	44.9328	-105.651	-80.9323	66	2	2	4337	0	31	26

Interface residues

• C-B: ALA242B, ALA242C, ALA249B, ALA249C, ARG198B, ARG198C, ARG201B, ARG201C, ARG246B, ARG246C, ARG253B, ARG253C, ASN200B, ASN200C, ASP217B, ASP217C, ASP243B, ASP243C, CYS197B, CYS197C, CYS216B, CYS216C, GLN247B, GLN247C, GLU193B, GLU193C, GLU211B, GLU211C, HIS245B, HIS245C, ILE196B, ILE196C, ILE212B, ILE212C, ILE250B, ILE250C, LEU214B, LEU214C, LEU215B, LEU215C, LYS195B, LYS195C, LYS218B, LYS218C, PHE213B, PHE213C, PHE239B, PHE239C, PHE252B, PHE252C, SER240B, SER240C, VAL199B, VAL199C, VAL219B, VAL219C, VAL244B, VAL244C, VAL248B, VAL248C, VAL251B, VAL251C
• C-D: ALA101D, ALA102D, ALA134D, ALA139D, ALA242C, ALA281D, ALA61D, ALA65D, ARG125D, ARG136D, ARG138D, ARG242D, ARG246C, ARG253C, ARG275D, ARG284D, ARG295C, ARG297C, ARG302C, ARG304C, ASN319C, ASN91D, ASP206D, ASP243C, ASP293C, ASP294C, ASP303D, ASP57D, ASP59D, ASP75D, ASP92D, CYS142D, CYS240D, GLN241C, GLN252D, GLN69D, GLN95D, GLU106D, GLU124D, GLU211C, GLU222C, GLU250D, GLU299C, GLU300C, GLU307C, GLU56D, GLU71D, GLY105D, GLY273D, GLY279D, GLY304D, GLY320C, GLY58D, GLY94D, HIS128D, HIS140D, HIS208D, HIS245C, HIS296C, HIS63D, HIS68D, HIS70D, HIS99D, ILE103D, ILE216D, ILE298C, ILE312C, ILE67D, LEU100D, LEU104D, LEU133D, LEU247D, LEU282D, LEU283D, LEU62D, LEU64D, LEU74D, LEU77D, LEU93D, LYS221C, LYS301C, LYS303C, LYS310C, LYS314C, LYS315C, MET271D, MET313C, PHE213C, PHE239C, PHE309C, PHE318C, PHE51D, PHE73D, PHE76D, PHE80D, PRO285D, PRO317C, PRO321C, PRO72D, SER238C, SER240C, SER280D, SER311C, SER316C, THR239D, THR292C, THR305C, THR308C, THR322C, THR55D, THR60D, TYR306C, TYR53D, TYR86D, VAL137D, VAL244C, VAL251C, VAL54D, VAL66D
• B-D: ALA123D, ALA264B, ARG125D, ARG198B, ARG201B, ARG242D, ARG267B, ARG270D, ARG275D, ARG284D, ARG297B, ARG302B, ASN200B, ASN202B, ASN204D, ASP206D, ASP217B, ASP293B, ASP57D, ASP92D, CYS197B, CYS216B, CYS240D, GLN287B, GLU203D, GLU237D, GLU250D, GLU282B, GLU285B, GLU56D, GLY126D, GLY127D, GLY204B, GLY207D, GLY241D, GLY273D, GLY274D, GLY58D, HIS208D, ILE196B, ILE212B, LEU214B, LEU215B, LEU247D, LEU289B, LEU89D, LYS195B, LYS235D, LYS301B, MET270B, MET271D, MET284B, PHE286B, PRO236D, PRO238D, PRO265B, PRO283B, PRO290B, SER203B, THR239D, THR292B, TYR205D, TYR272D, TYR288B, VAL199B, VAL54D