Project name: SH3_I111Q

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	IA111Q
Energy difference between WT (input) and mutated protein (by FoldX)	3.98143 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: 1.7909
• Average score: -1.024
• Total score value: -58.3683

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	0.3712
86	L	A	0.5983
87	F	A	0.7432
88	V	A	0.4220
89	A	A	0.0000
90	L	A	-0.1531
91	Y	A	-0.5748
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	-2.7282
105	K	A	-2.4059
106	G	A	-1.4600
107	E	A	-1.3163
108	K	A	-0.7476
109	F	A	0.0000
110	Q	A	-0.9198
111	Q	A	-0.8859	mutated: IA111Q
112	L	A	-0.2379
113	N	A	-1.1038
114	S	A	-1.3368
115	S	A	-1.5820
116	E	A	-2.5530
117	G	A	-2.1280
118	D	A	-2.4391
119	W	A	-1.0973
120	W	A	-1.2314
121	E	A	-1.3642
122	A	A	0.0000
123	R	A	-1.9296
124	S	A	0.0000
125	L	A	0.0296
126	T	A	-0.4881
127	T	A	-0.8294
128	G	A	-1.3650
129	E	A	-2.2470
130	T	A	-1.7937
131	G	A	-1.5832
132	Y	A	-0.9562
133	I	A	0.0000
134	P	A	0.0000
135	S	A	-1.0095
136	N	A	-1.1502
137	Y	A	-0.1262
138	V	A	0.0000
139	A	A	0.4103
140	P	A	0.7700
141	V	A	1.7909