2Y20

the mechanisms of hamp-mediated signaling in transmembrane receptors - the a291i mutant

• Total interactions analyzed: 15
• Total true interactions: 10
• Strongest Interaction:
  • Chains: E-F
  • Int. Res.: 82
  • Norm. En. per Res.: -3.9516
• 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	-10.9966	-68.929	-221.882	-301.8076	80	8	14	10525	5	25	14
A-C	0.0	23.2491	-40.1228	-16.8737	26	0	1	1806	0	13	15
A-D	0.0	-7.5763	-16.4384	-24.0147	18	0	2	921	0	7	4
B-C	0.0	0.0	-0.028	-0.028	5	0	0	17	0	4	1
B-D	0.0	29.7436	-25.9072	3.8364	21	0	0	1010	0	7	10
C-D	-7.5421	-77.1549	-231.189	-315.886	81	5	15	10604	5	27	16
C-E	-4.0143	2.2039	-64.4475	-66.2578	42	3	1	3209	2	14	19
C-F	0.0	0.0	-39.819	-39.819	25	0	0	1635	0	5	5
D-E	0.0	0.0	-19.0918	-19.0918	19	0	0	958	0	4	4
E-F	-10.7622	-87.4482	-225.819	-324.0294	82	10	15	10687	6	26	19

Interface residues

• A-B: ALA295A, ALA295B, ALA316A, ALA316B, ALA329B, ARG282A, ARG282B, ARG308A, ARG308B, ARG321A, ARG321B, ARG323A, ARG323B, ARG324A, ARG324B, ASN289A, ASN289B, ASP292A, ASP292B, ASP310A, ASP310B, GLU286A, GLU286B, GLU296A, GLU296B, GLU311A, GLU311B, GLU320A, GLU320B, GLY297A, GLY297B, GLY313A, GLY313B, HIS276B, ILE280A, ILE280B, ILE284A, ILE284B, ILE285A, ILE285B, ILE291A, ILE291B, ILE294A, ILE294B, ILE312A, ILE312B, ILE314A, ILE314B, ILE319A, ILE319B, LEU287A, LEU287B, LEU299A, LEU299B, LEU315A, LEU315B, LEU322A, LEU322B, LEU326A, LEU326B, LYS293A, LYS293B, LYS317A, LYS317B, MET277B, MET330A, PRO283A, PRO283B, SER288A, SER288B, SER318A, SER318B, SER325A, SER325B, THR279A, THR279B, THR281A, THR281B, THR290A, THR290B
• A-C: ALA309C, ALA329A, ARG308C, ARG321A, ARG321C, ARG323A, ARG324A, ARG324C, ASN307C, ASP310C, GLN306C, GLU311C, GLU320A, GLY313C, ILE312C, ILE314C, LEU315C, LEU322A, LEU326A, LYS317A, LYS317C, LYS327A, SER318A, SER318C, SER325A, VAL328A
• A-D: ALA329A, ARG282D, ARG321A, ARG324A, ASN289D, ASP292D, GLU286D, ILE284D, ILE285D, LEU326A, LYS327A, MET277D, MET330A, SER278D, SER288D, SER325A, THR281D, VAL328A
• B-C: ALA295B, ARG321C, ASP292B, GLU296B, ILE314C
• B-D: ALA295B, ARG282D, ASN289B, ASN289D, ASN298B, ASN298D, ASP292B, ASP292D, GLU286D, GLU296B, GLU296D, GLY297B, ILE285D, ILE291D, ILE294B, LEU299B, LYS293B, LYS293D, MET330B, SER288D, THR290D
• C-D: ALA295C, ALA295D, ALA316C, ALA316D, ALA329C, ARG282C, ARG282D, ARG308C, ARG308D, ARG321C, ARG321D, ARG323C, ARG323D, ARG324C, ARG324D, ASN289C, ASN289D, ASP292C, ASP292D, ASP310C, ASP310D, GLU286C, GLU286D, GLU296C, GLU296D, GLU311C, GLU311D, GLU320C, GLU320D, GLY297C, GLY297D, GLY313C, GLY313D, HIS276C, ILE280C, ILE280D, ILE284C, ILE284D, ILE285C, ILE285D, ILE291C, ILE291D, ILE294C, ILE294D, ILE312C, ILE312D, ILE314C, ILE314D, ILE319C, ILE319D, LEU287C, LEU287D, LEU299C, LEU299D, LEU315C, LEU315D, LEU322C, LEU322D, LEU326C, LEU326D, LYS293C, LYS293D, LYS317C, LYS317D, MET277C, MET277D, PRO283C, PRO283D, SER278D, SER288C, SER288D, SER318C, SER318D, SER325C, SER325D, THR279C, THR279D, THR281C, THR281D, THR290C, THR290D
• C-E: ALA301C, ALA301E, ARG282C, ARG282E, ASN289C, ASN289E, ASN298C, ASN298E, ASP292C, ASP292E, GLU286C, GLU286E, GLU302C, GLU302E, HIS276C, HIS276E, HIS305C, HIS305E, ILE280C, ILE280E, ILE284C, ILE284E, ILE285C, ILE285E, LEU287C, LEU287E, LYS293C, LYS293E, MET277C, MET277E, PRO283C, PRO283E, PRO304C, PRO304E, SER278C, SER278E, SER288C, SER288E, THR281C, THR281E, THR290C, THR290E
• C-F: ALA309F, ARG282C, ARG308F, ARG321F, ASN307F, ASP310F, GLU286C, GLU311F, GLY274C, GLY313F, HIS276C, ILE280C, ILE280F, ILE285C, ILE312F, ILE314F, LEU315F, LYS317F, MET277C, PRO283C, SER275C, SER278C, SER318F, THR279C, THR281C
• D-E: ALA309D, ARG282E, ARG308D, ARG321D, ASP310D, GLU286E, GLU311D, GLY313D, ILE285E, ILE312D, ILE314D, LEU315D, LYS317D, MET277E, PRO283E, SER275E, SER278E, SER318D, THR281E
• E-F: ALA295E, ALA295F, ALA316E, ALA316F, ALA329E, ALA329F, ARG282E, ARG282F, ARG308E, ARG308F, ARG321E, ARG321F, ARG323E, ARG323F, ARG324E, ARG324F, ASN289E, ASN289F, ASP292E, ASP292F, ASP310E, ASP310F, GLU286E, GLU286F, GLU296E, GLU296F, GLU311E, GLU311F, GLU320E, GLU320F, GLY297E, GLY297F, GLY313E, GLY313F, HIS276E, HIS276F, ILE280E, ILE280F, ILE284E, ILE284F, ILE285E, ILE285F, ILE291E, ILE291F, ILE294E, ILE294F, ILE312E, ILE312F, ILE314E, ILE314F, ILE319E, ILE319F, LEU287E, LEU287F, LEU299E, LEU299F, LEU315E, LEU315F, LEU322E, LEU322F, LEU326E, LEU326F, LYS293E, LYS293F, LYS317E, LYS317F, MET277E, MET277F, PRO283E, PRO283F, SER288E, SER288F, SER318E, SER318F, SER325E, SER325F, THR279E, THR279F, THR281E, THR281F, THR290E, THR290F