Project name: SH3_F86T

Status: done

submitted: 2019-03-14 15:10:27, status changed: 2019-03-14 15:36:21
Settings
Chain sequence(s) A: GSHMTFVALYDYESRTETDLSFKKGERLQIVNNTEGDWWLAHSLTTGQTGYIPSNYVAPS
Distance of aggregation 10 Å
Dynamic mode No
Mutated residues FA86T
Energy difference between WT (input) and mutated protein (by FoldX) 3.86697 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.

Show buried residues

Minimal score value
-3.4838
Maximal score value
1.2849
Average score
-0.8989
Total score value
-53.9346

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
residue index residue name chain Aggrescan3D score
mutation
81 G A -0.4595
82 S A -0.6971
83 H A -0.8249
84 M A 0.1609
85 T A 0.0000
86 T A 0.0000 mutated: FA86T
87 V A -0.7215
88 A A 0.0000
89 L A -0.3368
90 Y A -0.7367
91 D A -2.8528
92 Y A -2.1055
93 E A -2.8815
94 S A 0.0000
95 R A -2.7837
96 T A -2.1540
97 E A -2.3526
98 T A -1.2414
99 D A -1.3172
100 L A 0.0000
101 S A -1.9034
102 F A 0.0000
103 K A -3.4838
104 K A -2.8616
105 G A -1.9867
106 E A 0.0000
107 R A -2.1242
108 L A 0.0000
109 Q A -0.2890
110 I A 0.4504
111 V A 1.2849
112 N A -0.3899
113 N A -1.7837
114 T A -1.7232
115 E A -2.9242
116 G A -2.5982
117 D A -2.6730
118 W A -1.3180
119 W A -0.6360
120 L A 0.4432
121 A A 0.0000
122 H A -0.3658
123 S A 0.0000
124 L A -0.2796
125 T A -0.7803
126 T A -0.8780
127 G A -0.8169
128 Q A -1.4119
129 T A -0.4896
130 G A 0.0000
131 Y A 0.2426
132 I A 0.0000
133 P A 0.0000
134 S A -1.2663
135 N A -1.2431
136 Y A -0.2256
137 V A 0.0000
138 A A -0.0872
139 P A -0.2484
140 S A -0.2638

 

Laboratory of Theory of Biopolymers 2015