3PZ8

crystal structure of dvl1-dix(y17d) mutant

• Total interactions analyzed: 28
• Total true interactions: 18
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 60
  • Norm. En. per Res.: -5.8087
• Hub Node: A(6)

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	-81.7277	-112.4073	-154.388	-348.5231	60	8	3	6844	6	37	24
A-C	-24.654	0.0	-73.4395	-98.0935	24	5	2	2481	0	6	3
A-D	0.0	0.0	-0.1373	-0.1373	18	0	0	51	0	0	3
A-E	0.0	-3.7032	-0.4284	-4.1316	8	0	0	54	0	7	6
A-F	0.0	9.817	-0.7473	9.0697	3	0	0	54	0	0	12
A-H	-73.539	-109.7699	-152.669	-335.9779	62	19	3	7114	8	35	20
B-C	0.0	0.0	-0.025	-0.025	13	0	0	27	0	0	1
B-D	0.0	-16.8285	-1.7963	-18.6248	12	0	0	123	0	9	10
B-E	0.0	5.6036	-0.2348	5.3688	4	0	0	34	0	0	9
C-D	-51.6815	-112.7579	-149.787	-314.2264	59	6	3	6658	7	34	20
D-E	-30.5542	-73.0375	-116.621	-220.2127	53	14	3	5781	4	33	20
D-H	-10.5139	0.0	-67.0852	-77.5991	23	3	2	2498	0	6	3
E-F	-54.6001	-113.2186	-150.33	-318.1488	60	13	3	6684	8	36	26
E-G	-20.2101	-2.5673	-65.0516	-87.829	24	4	2	2437	0	6	3
E-H	0.0	0.0	-0.0671	-0.0671	10	0	0	34	0	0	0
F-G	0.0	0.0	-0.0472	-0.0472	15	0	0	38	0	0	0
F-H	0.0	0.0	-0.1692	-0.1692	8	0	0	23	0	5	4
G-H	-27.2172	-83.4319	-134.022	-244.6711	53	9	3	5964	6	29	13

Interface residues

• A-B: ALA44A, ALA84A, ARG40B, ARG76B, ASN35B, ASN39B, ASN74B, ASP17B, ASP3B, ASP53A, ASP55A, ASP65A, GLN54A, GLU13B, GLU14B, GLU61A, GLU62A, GLY57A, HIS9B, ILE63A, ILE6B, ILE7B, LEU18B, LEU21B, LEU37B, LEU83A, LYS20B, LYS34B, LYS46A, LYS50A, LYS50B, LYS5B, LYS60A, MET10B, MET52A, PHE48A, PHE49A, PHE56A, PHE64A, PHE73B, PRO16B, PRO22B, PRO71A, SER38B, SER51A, SER79B, THR15B, THR4B, TRP80A, TRP80B, TYR45A, TYR8B, VAL19B, VAL23B, VAL36B, VAL58A, VAL59A, VAL77B, VAL78B, VAL82A
• A-C: ASN74A, ASN74C, ASP53A, ASP53C, ASP55A, ASP55C, GLN54A, GLN54C, GLY57A, GLY57C, GLY75A, LYS50A, LYS50C, MET52A, MET52C, PHE56A, PHE56C, PHE73A, PHE73C, SER51C, VAL58A, VAL58C, VAL59A, VAL59C
• A-D: ARG76A, ARG76D, ASN74A, ASN74D, GLU14D, GLY57A, GLY57D, HIS9D, LYS50A, LYS50D, PHE56A, PHE56D, PRO16A, PRO16D, THR15A, THR15D, VAL58A, VAL58D
• A-E: GLU14A, GLU14E, HIS9A, HIS9E, LYS60A, LYS60E, TRP80A, TRP80E
• A-F: GLU14A, GLU14F, THR15F
• A-H: ALA44H, ALA68H, ALA84H, ARG40A, ARG76A, ASN35A, ASN39A, ASN74A, ASP17A, ASP3A, ASP53H, ASP55H, GLN54H, GLU13A, GLU14A, GLU61H, GLU62H, GLU85H, GLY57H, GLY86H, HIS9A, ILE63H, ILE7A, LEU18A, LEU21A, LEU37A, LEU83H, LYS20A, LYS34A, LYS46H, LYS50A, LYS50H, LYS5A, LYS60H, MET10A, MET52H, PHE33A, PHE47H, PHE48H, PHE49H, PHE56H, PHE64H, PHE73A, PRO16A, PRO22A, PRO41A, PRO71H, SER38A, SER51H, SER79A, THR15A, TRP80A, TRP80H, TYR45H, TYR8A, VAL19A, VAL36A, VAL58H, VAL59H, VAL77A, VAL78A, VAL82H
• B-C: ARG76B, ARG76C, ASN74B, ASN74C, GLY57B, LYS50B, LYS50C, PHE56C, PHE73B, PRO16C, THR15B, THR15C, VAL58B
• B-D: GLU14B, GLU14D, HIS9B, HIS9D, LYS60B, LYS60D, PRO16B, PRO16D, THR15B, TRP80B, TRP80D, VAL78B
• B-E: GLU13B, GLU14B, GLU14E, THR15E
• C-D: ALA68C, ALA84C, ARG40D, ARG76D, ASN35D, ASN39D, ASN74D, ASP17D, ASP3D, ASP53C, ASP55C, ASP65C, GLN54C, GLU13D, GLU14D, GLU61C, GLU62C, GLY57C, HIS9D, ILE63C, ILE6D, ILE7D, LEU18D, LEU21D, LEU37D, LEU83C, LYS20D, LYS46C, LYS50C, LYS50D, LYS5D, LYS60C, MET10D, MET52C, PHE47C, PHE48C, PHE49C, PHE56C, PHE64C, PHE73C, PHE73D, PRO16D, PRO22D, PRO71C, SER38D, SER51C, SER79D, THR15D, TRP80C, TRP80D, TYR45C, TYR8D, VAL19D, VAL36D, VAL58C, VAL59C, VAL77D, VAL78D, VAL82C
• D-E: ALA84D, ARG40E, ARG76E, ASN39E, ASN74E, ASP17E, ASP53D, ASP55D, GLN54D, GLU13E, GLU14E, GLU61D, GLU62D, GLY57D, GLY75E, HIS9E, ILE63D, ILE6E, ILE7E, LEU18E, LEU21E, LEU37E, LEU83D, LYS20E, LYS46D, LYS50D, LYS50E, LYS5E, LYS60D, MET10E, MET52D, PHE48D, PHE49D, PHE56D, PHE64D, PHE73E, PRO16E, PRO22E, PRO41E, PRO71D, SER38E, SER51D, THR15E, TRP80D, TRP80E, TYR8E, VAL19E, VAL36E, VAL58D, VAL59D, VAL77E, VAL78E, VAL82D
• D-H: ASN74D, ASN74H, ASP53D, ASP53H, ASP55D, ASP55H, GLN54D, GLN54H, GLY57D, GLY57H, LYS50D, LYS50H, MET52D, MET52H, PHE56D, PHE56H, PHE73D, PHE73H, SER51D, VAL58D, VAL58H, VAL59D, VAL59H
• E-F: ALA68E, ALA84E, ARG40F, ARG76F, ASN35F, ASN39F, ASN74F, ASP17F, ASP3F, ASP53E, ASP55E, ASP65E, GLN54E, GLU13F, GLU14F, GLU61E, GLU62E, GLY57E, HIS9F, ILE63E, ILE6F, ILE7F, LEU18F, LEU21F, LEU37F, LEU83E, LYS20F, LYS34F, LYS46E, LYS50E, LYS50F, LYS5F, LYS60E, MET10F, MET52E, PHE33F, PHE47E, PHE48E, PHE49E, PHE56E, PHE64E, PHE73F, PRO16F, PRO22F, PRO71E, SER38F, SER51E, SER79F, THR15F, TRP80E, TRP80F, TYR45E, TYR8F, VAL19F, VAL36F, VAL58E, VAL59E, VAL77F, VAL78F, VAL82E
• E-G: ASN74E, ASN74G, ASP53E, ASP53G, ASP55E, ASP55G, GLN54E, GLN54G, GLY57E, GLY57G, GLY75G, LYS50E, LYS50G, MET52E, MET52G, PHE56E, PHE56G, PHE73E, PHE73G, SER51G, VAL58E, VAL58G, VAL59E, VAL59G
• E-H: ARG76E, ARG76H, ASN74E, ASN74H, LYS50E, LYS50H, PHE56E, PRO16H, THR15H, VAL58E
• F-G: ARG76F, ARG76G, ASN74F, ASN74G, GLY57F, LYS50F, LYS50G, PHE56F, PHE56G, PHE73F, PHE73G, PRO16G, THR15F, THR15G, VAL58F
• F-H: GLU14F, GLU14H, HIS9F, HIS9H, PRO16F, PRO16H, TRP80F, TRP80H
• G-H: ALA68G, ARG40H, ARG76H, ASN35H, ASN39H, ASN74H, ASP11H, ASP17H, ASP53G, ASP55G, GLN54G, GLU14H, GLU61G, GLU62G, GLY57G, GLY75H, HIS9H, ILE63G, ILE7H, LEU18H, LEU21H, LEU37H, LEU83G, LYS20H, LYS46G, LYS50G, LYS50H, LYS5H, LYS60G, MET10H, MET52G, PHE48G, PHE49G, PHE56G, PHE64G, PHE73H, PRO16H, PRO22H, PRO71G, SER38H, SER51G, SER79H, THR15H, TRP80G, TRP80H, TYR8H, VAL19H, VAL36H, VAL58G, VAL59G, VAL77H, VAL78H, VAL82G