Project name: SH3_E107M

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	EA107M
Energy difference between WT (input) and mutated protein (by FoldX)	0.516013 kcal/mol Changes in protein stability upon mutation are calculated using the FoldX forcefield. Computational prediction of protein stability is used with the intention of preventing the experimental characterization of proteins bearing mutations that significantly destabilize their structure. Mutations resulting in a predicted reduction in protein stability ≥ 1 kcal/mol are considered disruptive.

• Minimal score value: -3.1032
• Maximal score value: 1.7964
• Average score: -0.9338
• Total score value: -53.2267

The table below lists A3D score for protein residues. Residues with A3D score > 0.0000 are marked by yellow rows.

residue index	residue name	chain	Aggrescan3D score	mutation
85	T	A	0.5173
86	L	A	0.7932
87	F	A	0.9779
88	V	A	0.5421
89	A	A	0.0000
90	L	A	-0.0985
91	Y	A	-0.5299
92	D	A	-2.5122
93	Y	A	-1.9323
94	E	A	-2.6463
95	A	A	-2.6270
96	R	A	-2.9856
97	T	A	-2.6612
98	E	A	-3.1032
99	D	A	-3.0437
100	D	A	0.0000
101	L	A	0.0000
102	S	A	-2.2063
103	F	A	0.0000
104	H	A	-2.6205
105	K	A	-2.2955
106	G	A	-1.2869
107	M	A	-0.9535	mutated: EA107M
108	K	A	-0.4709
109	F	A	0.0000
110	Q	A	-0.5091
111	I	A	-0.0568
112	L	A	0.1429
113	N	A	-0.8879
114	S	A	-1.1794
115	S	A	-1.5962
116	E	A	-2.5599
117	G	A	-2.1340
118	D	A	-2.4444
119	W	A	-1.1028
120	W	A	-1.0557
121	E	A	-1.1530
122	A	A	0.0000
123	R	A	-1.7091
124	S	A	0.0000
125	L	A	0.1365
126	T	A	-0.3822
127	T	A	-0.7714
128	G	A	-1.3468
129	E	A	-2.2207
130	T	A	-1.6833
131	G	A	-1.4953
132	Y	A	-0.8677
133	I	A	0.0000
134	P	A	0.0000
135	S	A	-0.9206
136	N	A	-1.1504
137	Y	A	-0.1243
138	V	A	0.0000
139	A	A	0.4158
140	P	A	0.7757
141	V	A	1.7964