1M7E

crystal structure of the phosphotyrosine binding domain(ptb) of mouse disabled 2(dab2):implications for reeling signaling

• Total interactions analyzed: 15
• Total true interactions: 7
• Strongest Interaction:
  • Chains: C-F
  • Int. Res.: 59
  • Norm. En. per Res.: -5.9388
• 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	-13.4596	10.9456	-55.428	-57.9419	28	4	0	2390	0	16	18
A-C	0.0	2.3197	-85.2295	-82.9098	49	6	1	3999	0	16	13
A-D	-66.9985	-22.2859	-232.421	-321.7055	60	16	3	7622	0	9	9
B-C	-16.4417	-8.9368	-70.7474	-96.1259	74	12	2	3623	0	23	20
B-D	0.0	0.0	-0.6823	-0.6823	11	0	0	130	0	1	1
B-E	-55.5264	-22.0749	-203.48	-281.0813	58	13	3	7357	1	9	9
C-F	-85.6043	-22.978	-241.804	-350.3863	59	12	3	7662	0	9	9

Interface residues

• A-B: ASP106B, ASP127A, ASP130A, ASP46B, ASP66A, ASP71A, GLN70A, GLU113B, GLU115B, GLY110B, GLY65A, HIS114B, HIS116B, ILE102B, ILE104B, ILE105B, ILE112B, LYS103B, LYS108B, LYS67A, MET68A, MET74A, SER100B, SER69A, THR109B, THR129A, VAL111B, VAL128A
• A-C: ALA80A, ALA80C, ALA81A, ALA81C, ALA82A, ALA82C, ASN131A, ASP127A, ASP127C, ASP130A, ASP130C, ASP58A, ASP58C, ASP59A, ASP59C, ASP71A, ASP71C, GLN70A, GLN70C, GLN86A, GLN86C, GLY78A, GLY78C, GLY83A, GLY83C, LEU76A, LEU76C, LYS67A, LYS67C, LYS75A, LYS75C, LYS77A, LYS77C, MET68A, MET68C, MET73A, MET73C, MET74A, MET74C, MET79A, MET79C, SER72A, SER72C, SER85A, SER85C, THR129A, THR129C, VAL128A, VAL128C
• A-D: ALA125A, ALA63A, ARG126A, ARG64A, ASN119A, ASN171A, ASN501D, ASN505D, ASP127A, ASP161A, ASP164A, ASP66A, CYS138A, GLN143A, GLN167A, GLN70A, GLU141A, GLU156A, GLU504D, GLY101A, GLY135A, GLY139A, GLY140A, GLY142A, GLY502D, GLY65A, HIS144A, ILE102A, ILE121A, ILE124A, ILE169A, ILE97A, LEU158A, LEU162A, LEU165A, LYS120A, LYS163A, LYS173A, LYS174A, LYS509D, LYS67A, PHE123A, PHE134A, PHE166A, PRO117A, PRO506D, SER122A, SER69A, THR507D, TYR136A, TYR170A, TYR503D, TYR508D, VAL118A, VAL128A, VAL137A, VAL159A, VAL160A, VAL168A, VAL172A
• B-C: ALA80B, ALA80C, ALA81B, ALA81C, ALA82B, ALA82C, ARG84B, ARG84C, ARG92B, ARG92C, ASP106B, ASP106C, ASP58B, ASP58C, ASP59B, ASP59C, GLN143B, GLN143C, GLN145B, GLN145C, GLN86B, GLN86C, GLN88B, GLN88C, GLN91B, GLN91C, GLU107B, GLU107C, GLU113B, GLU113C, GLU115B, GLU115C, GLU141B, GLU141C, GLY110B, GLY110C, GLY139B, GLY139C, GLY140B, GLY140C, GLY142B, GLY142C, GLY78B, GLY78C, GLY83B, GLY83C, GLY87B, GLY87C, HIS114B, HIS114C, HIS116B, HIS116C, HIS144B, HIS144C, ILE112B, ILE112C, ILE57B, ILE57C, LYS108B, LYS108C, LYS75B, LYS75C, MET79B, MET79C, PHE147B, PHE147C, SER85B, SER85C, THR109B, THR109C, VAL111B, VAL111C, VAL60B, VAL60C
• B-D: ASN501D, ASN96B, ASP46B, GLU504D, GLY110B, GLY45B, GLY502D, ILE105B, ILE112B, LYS103B, LYS44B
• B-E: ALA125B, ALA63B, ARG126B, ARG64B, ASN119B, ASN171B, ASN501E, ASN505E, ASP127B, ASP161B, ASP164B, ASP66B, CYS138B, GLN143B, GLN167B, GLN70B, GLU141B, GLU156B, GLU177B, GLU504E, GLY135B, GLY139B, GLY140B, GLY142B, GLY502E, GLY65B, HIS144B, ILE102B, ILE121B, ILE124B, ILE169B, LEU158B, LEU162B, LEU165B, LYS120B, LYS163B, LYS173B, LYS174B, LYS509E, PHE123B, PHE134B, PHE166B, PRO117B, PRO506E, SER122B, SER69B, THR507E, TYR136B, TYR170B, TYR503E, TYR508E, VAL118B, VAL128B, VAL137B, VAL159B, VAL160B, VAL168B, VAL172B
• C-F: ALA125C, ALA63C, ARG126C, ARG64C, ASN119C, ASN171C, ASN501F, ASN505F, ASP127C, ASP161C, ASP164C, ASP62C, ASP66C, CYS138C, GLN143C, GLN145C, GLN167C, GLN70C, GLU141C, GLU156C, GLU504F, GLY135C, GLY139C, GLY140C, GLY142C, GLY502F, GLY65C, HIS144C, ILE121C, ILE124C, ILE169C, LEU158C, LEU162C, LEU165C, LYS120C, LYS163C, LYS173C, LYS174C, LYS509F, LYS67C, PHE123C, PHE134C, PHE166C, PRO117C, PRO506F, SER122C, SER69C, THR507F, TYR136C, TYR170C, TYR503F, TYR508F, VAL118C, VAL128C, VAL137C, VAL159C, VAL160C, VAL168C, VAL172C