Project name: SH3_K108A

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	KA108A
Energy difference between WT (input) and mutated protein (by FoldX)	1.83588 kcal/mol CAUTION: Your mutation/s can destabilize the protein structure 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: -3.1028
• Maximal score value: 1.9744
• Average score: -0.8778
• Total score value: -50.0351

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	0.5718
86	L	A	1.1137
87	F	A	1.2597
88	V	A	0.8603
89	A	A	0.0000
90	L	A	-0.0548
91	Y	A	-0.5687
92	D	A	-2.5599
93	Y	A	-1.9315
94	E	A	-2.6452
95	A	A	-2.6259
96	R	A	-2.9852
97	T	A	-2.6608
98	E	A	-3.1028
99	D	A	-3.0434
100	D	A	0.0000
101	L	A	0.0000
102	S	A	-2.2059
103	F	A	0.0000
104	H	A	-2.6250
105	K	A	-2.2854
106	G	A	-1.2368
107	E	A	-0.8852
108	A	A	0.2342	mutated: KA108A
109	F	A	0.0000
110	Q	A	-0.2767
111	I	A	0.0520
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	-1.5631
124	S	A	0.0000
125	L	A	0.4260
126	T	A	-0.2514
127	T	A	-0.7126
128	G	A	-1.3296
129	E	A	-2.2256
130	T	A	-1.6827
131	G	A	-1.4992
132	Y	A	-0.8673
133	I	A	0.0000
134	P	A	0.0000
135	S	A	-0.9206
136	N	A	-1.1504
137	Y	A	-0.1167
138	V	A	0.0000
139	A	A	0.5402
140	P	A	0.9154
141	V	A	1.9744