Project name: 3EXG pyruvate dehydrogenase E1 alpha chain A

Chain sequence(s)	A: MFANDATFEIKKCDLHRLEEGPPVTTVLTREDGLKYYRMMQTVRRMELKADQLYKQKIIRGFCHLCDGQEACCVGLEAGINPTDHLITAYRAHGFTFTRGLSVREILAELTGRKGGCAKGKGGSMHMYAKNFYGGNGIVGAQVPLGAGIALACKYNGKDEVCLTLYGDGAANQGQIFEAYNMAALWKLPCIFICENNRRAAASTDYYKRGDFIPGLRVDGMDILCVREATRFAAAYCRSGKGPILMELQTYRYHTREEIQEVRSKSDPIMLLKDRMVNSNLASVEELKEIDVEVRKEIEDAAQFATADPEPPLEELGYHIYSSDPPFEVRGANQWIKFKSVS
Distance of aggregation	10 Å
Dynamic mode	No

• Minimal score value: -5.2157
• Maximal score value: 2.3354
• Average score: -0.8597
• Total score value: -294.0254

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
0	M	A	1.1534
1	F	A	0.4566
2	A	A	-0.7792
3	N	A	-2.2061
4	D	A	-1.9773
5	A	A	-0.6941
6	T	A	-0.1330
7	F	A	0.0000
8	E	A	-2.0838
9	I	A	0.0000
10	K	A	-2.9020
11	K	A	-2.7604
12	C	A	-1.7806
13	D	A	-1.5729
14	L	A	-1.5170
15	H	A	-1.9203
16	R	A	-2.5548
17	L	A	-2.1907
18	E	A	-2.9895
19	E	A	-2.9361
20	G	A	-1.5431
21	P	A	0.0000
22	P	A	-0.8197
23	V	A	-0.8362
24	T	A	-0.6097
25	T	A	0.4232
26	V	A	1.0520
27	L	A	0.0000
28	T	A	-1.5860
29	R	A	-2.2922
30	E	A	-2.9911
31	D	A	-2.3649
32	G	A	0.0000
33	L	A	-1.9886
34	K	A	-2.7884
35	Y	A	0.0000
36	Y	A	0.0000
37	R	A	-2.5027
38	M	A	-1.1682
39	M	A	0.0000
40	Q	A	0.0000
41	T	A	0.0000
42	V	A	0.0000
43	R	A	-0.8727
44	R	A	-1.9608
45	M	A	0.0000
46	E	A	0.0000
47	L	A	-0.2078
48	K	A	-0.9747
49	A	A	0.0000
50	D	A	-1.2266
51	Q	A	-1.5963
52	L	A	0.0000
53	Y	A	-1.7625
54	K	A	-3.0189
55	Q	A	-2.9711
56	K	A	-3.1134
57	I	A	-1.4253
58	I	A	0.0000
59	R	A	-2.1974
60	G	A	-0.5655
61	F	A	1.3124
62	C	A	0.5609
63	H	A	0.1997
64	L	A	0.0000
65	C	A	0.0000
66	D	A	0.0000
67	G	A	0.0000
68	Q	A	0.0000
69	E	A	0.0000
70	A	A	0.0000
71	C	A	0.0000
72	C	A	0.0000
73	V	A	0.0000
74	G	A	0.0000
75	L	A	0.0000
76	E	A	-0.7493
77	A	A	-0.7275
78	G	A	-1.0124
79	I	A	0.0000
80	N	A	-1.5943
81	P	A	-1.3541
82	T	A	-1.3882
83	D	A	0.0000
84	H	A	-0.6259
85	L	A	0.0000
86	I	A	0.0000
87	T	A	0.0000
88	A	A	0.5433
89	Y	A	0.6936
90	R	A	-0.0173
91	A	A	0.0000
92	H	A	0.0000
93	G	A	0.0000
94	F	A	0.0000
95	T	A	0.0000
96	F	A	0.1693
97	T	A	-0.0383
98	R	A	0.0000
99	G	A	-0.5991
100	L	A	-0.4327
101	S	A	-0.8295
102	V	A	0.0000
103	R	A	-2.8482
104	E	A	-1.6830
105	I	A	0.0000
106	L	A	0.0000
107	A	A	0.0000
108	E	A	0.0000
109	L	A	0.0000
110	T	A	0.0000
111	G	A	-1.7572
112	R	A	-2.2882
113	K	A	-2.8015
114	G	A	-1.8304
115	G	A	0.0000
116	C	A	-0.9391
117	A	A	-1.1146
118	K	A	-2.5891
119	G	A	-2.2177
120	K	A	-1.8223
121	G	A	-0.9420
122	G	A	-0.7798
123	S	A	0.0000
124	M	A	0.5836
125	H	A	-0.1176
126	M	A	0.0000
127	Y	A	0.9863
128	A	A	-0.1722
129	K	A	-1.6537
130	N	A	-0.9628
131	F	A	0.0000
132	Y	A	0.5757
133	G	A	0.0000
134	G	A	0.0000
135	N	A	0.6860
136	G	A	1.2223
137	I	A	2.3354
138	V	A	1.4432
139	G	A	0.0000
140	A	A	0.7861
141	Q	A	0.0000
142	V	A	0.0000
143	P	A	0.0391
144	L	A	0.8122
145	G	A	0.0000
146	A	A	0.0000
147	G	A	0.0890
148	I	A	0.3266
149	A	A	0.0000
150	L	A	-0.0612
151	A	A	-0.3742
152	C	A	0.0000
153	K	A	-2.1915
154	Y	A	-0.4528
155	N	A	-2.0242
156	G	A	-2.6424
157	K	A	-3.4218
158	D	A	-3.5139
159	E	A	-2.5426
160	V	A	0.0000
161	C	A	0.0000
162	L	A	0.0000
163	T	A	0.0000
164	L	A	0.0000
165	Y	A	0.0000
166	G	A	-0.5461
167	D	A	-1.1198
168	G	A	-0.9645
169	A	A	0.0000
170	A	A	-0.7721
171	N	A	-1.2626
172	Q	A	-1.1053
173	G	A	-1.1483
174	Q	A	-1.1721
175	I	A	0.0000
176	F	A	-0.4066
177	E	A	-1.7147
178	A	A	0.0000
179	Y	A	0.0000
180	N	A	-0.8325
181	M	A	0.0390
182	A	A	0.0000
183	A	A	0.0438
184	L	A	1.1640
185	W	A	0.4035
186	K	A	-1.5267
187	L	A	0.0000
188	P	A	-1.4045
189	C	A	0.0000
190	I	A	0.0000
191	F	A	0.0000
192	I	A	0.0000
193	C	A	0.0000
194	E	A	0.0000
195	N	A	0.0000
196	N	A	-1.5443
197	R	A	-2.2450
206	R	A	-1.8287
207	A	A	-1.1157
208	A	A	-0.9203
209	A	A	-0.5550
210	S	A	-0.8186
211	T	A	-1.0350
212	D	A	-1.0346
213	Y	A	0.0000
214	Y	A	0.0000
215	K	A	-1.9031
216	R	A	-1.4708
217	G	A	0.0000
218	D	A	-2.0228
219	F	A	-0.7372
220	I	A	0.0000
221	P	A	0.0000
222	G	A	0.0000
223	L	A	0.0000
224	R	A	-1.1667
225	V	A	0.0000
226	D	A	-1.1740
227	G	A	0.0000
228	M	A	0.0000
229	D	A	0.0000
230	I	A	0.0000
231	L	A	0.0000
232	C	A	0.0000
233	V	A	0.0000
234	R	A	0.0000
235	E	A	-0.4075
236	A	A	0.0000
237	T	A	0.0000
238	R	A	-1.5949
239	F	A	-0.4580
240	A	A	0.0000
241	A	A	0.0000
242	A	A	-0.8660
243	Y	A	-0.7403
244	C	A	0.0000
245	R	A	-2.1191
246	S	A	-1.4269
247	G	A	-2.2992
248	K	A	-2.4335
249	G	A	0.0000
250	P	A	0.0000
251	I	A	0.0000
252	L	A	0.0000
253	M	A	0.0000
254	E	A	0.0000
255	L	A	0.0000
256	Q	A	-1.0499
257	T	A	0.0000
258	Y	A	0.0000
259	R	A	-1.2554
260	Y	A	0.0000
261	H	A	-1.0767
274	T	A	-2.0931
275	R	A	-3.5995
276	E	A	-4.2149
277	E	A	-3.9338
278	I	A	-3.0609
279	Q	A	-3.5031
280	E	A	-3.8862
281	V	A	-2.5862
282	R	A	-2.6046
283	S	A	-2.0163
284	K	A	-2.5229
285	S	A	-1.3765
286	D	A	0.0000
287	P	A	0.0000
288	I	A	0.0000
289	M	A	-0.4873
290	L	A	-0.5315
291	L	A	0.0000
292	K	A	-1.0517
293	D	A	-1.8768
294	R	A	-1.5991
295	M	A	0.0000
296	V	A	-1.1632
297	N	A	-1.9430
298	S	A	-1.5951
299	N	A	-1.3630
300	L	A	0.0000
301	A	A	0.0000
302	S	A	-0.7905
303	V	A	-0.5557
304	E	A	-2.3462
305	E	A	-1.8342
306	L	A	0.0000
307	K	A	-3.2896
308	E	A	-3.7121
309	I	A	0.0000
310	D	A	-3.7468
311	V	A	-3.1469
312	E	A	-4.4749
313	V	A	0.0000
314	R	A	-4.8738
315	K	A	-5.2157
316	E	A	-5.1521
317	I	A	0.0000
318	E	A	-5.1215
319	D	A	-4.4943
320	A	A	0.0000
321	A	A	0.0000
322	Q	A	-2.3517
323	F	A	-1.3444
324	A	A	0.0000
325	T	A	-0.4892
326	A	A	-0.5255
327	D	A	-1.1370
328	P	A	-1.5825
329	E	A	-2.5111
330	P	A	-1.8893
331	P	A	-0.6901
332	L	A	0.6169
333	E	A	-1.3291
334	E	A	-0.6794
335	L	A	0.8401
336	G	A	0.0000
337	Y	A	-0.0876
338	H	A	-0.0445
339	I	A	1.5877
340	Y	A	1.1247
341	S	A	-0.1007
342	S	A	-0.8676
343	D	A	-1.4671
344	P	A	-0.8830
345	P	A	-0.9706
346	F	A	-1.0118
347	E	A	-2.6031
348	V	A	-1.7676
349	R	A	-3.0697
350	G	A	-1.6462
351	A	A	-1.1912
352	N	A	-2.0110
353	Q	A	-1.8962
354	W	A	-0.3753
355	I	A	-1.2826
356	K	A	-3.0131
357	F	A	-1.8262
358	K	A	-2.4599
359	S	A	0.0000
360	V	A	-0.4458
361	S	A	-0.2127