## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
1 |
|
B |
356 |
93 |
24120 |
◊ |
B |
x,-y+1,-z |
4_565 |
356 |
93 |
24120 |
3281.5 |
-33.9 |
0.025 |
20 |
14 |
0 |
0.093 |
2 |
|
A |
364 |
94 |
23737 |
◊ |
A |
x,-y+1,-z |
4_565 |
364 |
94 |
23737 |
3253.1 |
-33.8 |
0.031 |
17 |
18 |
0 |
0.093 |
Average: |
3267.3 |
-33.8 |
0.028 |
19 |
16 |
0 |
0.093 |
2 |
3 |
|
B |
138 |
34 |
24120 |
◊ |
A |
x,y,z |
1_555 |
139 |
37 |
23737 |
1269.8 |
-7.8 |
0.441 |
11 |
4 |
0 |
0.026 |
3 |
4 |
|
B |
81 |
22 |
24120 |
◊ |
A |
x,-y+1,-z |
4_565 |
81 |
22 |
23737 |
827.4 |
-7.8 |
0.218 |
3 |
4 |
0 |
0.019 |
4 |
5 |
|
[FAD]A:701 |
53 |
1 |
999 |
f |
A |
x,y,z |
1_555 |
93 |
37 |
23737 |
703.4 |
-12.0 |
0.299 |
10 |
0 |
0 |
0.068 |
6 |
|
[FAD]B:701 |
52 |
1 |
1001 |
f |
B |
x,y,z |
1_555 |
92 |
35 |
24120 |
700.9 |
-12.0 |
0.304 |
10 |
0 |
0 |
0.068 |
Average: |
702.2 |
-12.0 |
0.302 |
10 |
0 |
0 |
0.068 |
5 |
7 |
|
B |
71 |
21 |
24120 |
◊ |
A |
-x+1,y,-z+1/2 |
3_655 |
74 |
23 |
23737 |
657.4 |
-2.8 |
0.535 |
2 |
2 |
0 |
0.000 |
6 |
8 |
|
B |
57 |
14 |
24120 |
◊ |
A |
x-1/2,y+1/2,z |
5_455 |
58 |
23 |
23737 |
514.7 |
1.6 |
0.832 |
1 |
2 |
0 |
0.000 |
7 |
9 |
|
B |
39 |
11 |
24120 |
◊ |
B |
-x+1,y,-z+1/2 |
3_655 |
40 |
11 |
24120 |
339.0 |
4.2 |
0.946 |
3 |
0 |
0 |
0.000 |
8 |
10 |
|
[TDP]A:704 |
25 |
1 |
597 |
f |
A |
x,y,z |
1_555 |
53 |
23 |
23737 |
313.9 |
-5.5 |
0.242 |
7 |
0 |
0 |
0.036 |
11 |
|
[TDP]B:704 |
26 |
1 |
596 |
f |
B |
x,y,z |
1_555 |
55 |
23 |
24120 |
312.6 |
-5.5 |
0.250 |
7 |
0 |
0 |
0.036 |
Average: |
313.3 |
-5.5 |
0.246 |
7 |
0 |
0 |
0.036 |
9 |
12 |
|
B |
18 |
5 |
24120 |
◊ |
A |
x-1/2,-y+1/2,-z |
8_455 |
11 |
3 |
23737 |
143.2 |
-0.8 |
0.495 |
1 |
2 |
0 |
0.000 |
10 |
13 |
|
[GOL]B:709 |
6 |
1 |
218 |
f |
B |
x,y,z |
1_555 |
24 |
11 |
24120 |
143.0 |
-1.6 |
0.373 |
2 |
0 |
0 |
0.010 |
11 |
14 |
|
[GOL]B:708 |
6 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
21 |
6 |
24120 |
138.6 |
-1.1 |
0.486 |
0 |
0 |
0 |
0.004 |
12 |
15 |
|
[GOL]A:710 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
23 |
7 |
23737 |
137.2 |
-0.4 |
0.570 |
1 |
0 |
0 |
0.004 |
13 |
16 |
|
[TDP]B:704 |
13 |
1 |
596 |
◊ |
B |
x,-y+1,-z |
4_565 |
19 |
10 |
24120 |
130.3 |
2.1 |
0.653 |
0 |
0 |
0 |
0.000 |
17 |
|
[TDP]A:704 |
13 |
1 |
597 |
◊ |
A |
x,-y+1,-z |
4_565 |
19 |
10 |
23737 |
129.8 |
2.1 |
0.660 |
1 |
0 |
0 |
0.000 |
Average: |
130.1 |
2.1 |
0.656 |
1 |
0 |
0 |
0.000 |
14 |
18 |
|
[GOL]A:706 |
6 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
21 |
8 |
23737 |
130.3 |
0.6 |
0.697 |
3 |
0 |
0 |
0.003 |
19 |
|
[GOL]B:706 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
22 |
8 |
24120 |
130.0 |
0.7 |
0.698 |
3 |
0 |
0 |
0.003 |
Average: |
130.2 |
0.7 |
0.697 |
3 |
0 |
0 |
0.003 |
15 |
20 |
|
[GOL]A:705 |
6 |
1 |
220 |
f |
A |
x,y,z |
1_555 |
23 |
8 |
23737 |
121.8 |
-0.7 |
0.516 |
0 |
0 |
0 |
0.003 |
16 |
21 |
|
[GOL]A:708 |
5 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
20 |
9 |
23737 |
121.1 |
0.0 |
0.647 |
3 |
0 |
0 |
0.005 |
17 |
22 |
|
[GOL]B:707 |
6 |
1 |
218 |
f |
B |
x,y,z |
1_555 |
16 |
7 |
24120 |
95.7 |
1.2 |
0.785 |
2 |
0 |
0 |
0.000 |
18 |
23 |
|
[GOL]A:709 |
6 |
1 |
217 |
f |
A |
x,y,z |
1_555 |
14 |
7 |
23737 |
95.6 |
0.3 |
0.649 |
1 |
0 |
0 |
0.000 |
19 |
24 |
|
[GOL]B:705 |
6 |
1 |
217 |
◊ |
B |
x,y,z |
1_555 |
15 |
7 |
24120 |
95.4 |
-0.3 |
0.577 |
0 |
0 |
0 |
0.000 |
20 |
25 |
|
[K]B:702 |
1 |
1 |
216 |
f |
[K]B:702 |
x,-y+1,-z |
4_565 |
1 |
1 |
216 |
90.8 |
-90.8 |
0.000 |
0 |
0 |
0 |
0.188 |
21 |
26 |
|
[PO4]B:710 |
5 |
1 |
187 |
f |
B |
x,-y+1,-z |
4_565 |
14 |
7 |
24120 |
90.4 |
-5.4 |
0.795 |
1 |
0 |
0 |
0.024 |
22 |
27 |
|
[K]A:702 |
1 |
1 |
216 |
f |
[K]A:702 |
x,-y+1,-z |
4_565 |
1 |
1 |
216 |
90.3 |
-90.3 |
0.000 |
0 |
0 |
0 |
0.184 |
23 |
28 |
|
[PO4]A:712 |
5 |
1 |
187 |
f |
A |
x,-y+1,-z |
4_565 |
13 |
6 |
23737 |
90.0 |
-5.4 |
0.789 |
1 |
0 |
0 |
0.024 |
24 |
29 |
|
[GOL]A:711 |
6 |
1 |
217 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
23737 |
89.0 |
-1.6 |
0.301 |
0 |
0 |
0 |
0.006 |
25 |
30 |
|
[K]B:702 |
1 |
1 |
216 |
x |
B |
x,y,z |
1_555 |
13 |
6 |
24120 |
88.6 |
-62.7 |
0.000 |
0 |
0 |
0 |
0.518 |
31 |
|
[K]A:702 |
1 |
1 |
216 |
x |
A |
x,y,z |
1_555 |
13 |
6 |
23737 |
88.3 |
-62.9 |
0.000 |
0 |
0 |
0 |
0.518 |
Average: |
88.4 |
-62.8 |
0.000 |
0 |
0 |
0 |
0.518 |
26 |
32 |
|
[GOL]A:707 |
6 |
1 |
218 |
◊ |
A |
x,-y+1,-z |
4_565 |
9 |
4 |
23737 |
73.1 |
0.3 |
0.616 |
0 |
0 |
0 |
0.000 |
27 |
33 |
|
[FAD]A:701 |
11 |
1 |
999 |
◊ |
A |
x,-y+1,-z |
4_565 |
7 |
1 |
23737 |
61.8 |
-2.0 |
0.203 |
0 |
0 |
0 |
0.008 |
34 |
|
[FAD]B:701 |
12 |
1 |
1001 |
◊ |
B |
x,-y+1,-z |
4_565 |
8 |
1 |
24120 |
61.4 |
-2.0 |
0.236 |
0 |
0 |
0 |
0.008 |
Average: |
61.6 |
-2.0 |
0.219 |
0 |
0 |
0 |
0.008 |
28 |
35 |
|
[GOL]A:707 |
5 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
11 |
2 |
23737 |
59.8 |
-1.6 |
0.309 |
0 |
0 |
0 |
0.006 |
29 |
36 |
|
[GOL]A:711 |
4 |
1 |
217 |
◊ |
B |
-x+1,y,-z+1/2 |
3_655 |
4 |
1 |
24120 |
41.9 |
0.4 |
0.699 |
0 |
0 |
0 |
0.000 |
30 |
37 |
|
[GOL]B:705 |
5 |
1 |
217 |
f |
A |
x-1/2,y+1/2,z |
5_455 |
6 |
2 |
23737 |
40.2 |
-0.5 |
0.457 |
0 |
0 |
0 |
0.002 |
31 |
38 |
|
[MG]B:703 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
10 |
8 |
24120 |
38.4 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.025 |
39 |
|
[MG]A:703 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
8 |
23737 |
38.2 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.025 |
Average: |
38.3 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.025 |
32 |
40 |
|
[PO4]B:710 |
4 |
1 |
187 |
◊ |
[TDP]B:704 |
x,y,z |
1_555 |
7 |
1 |
596 |
33.9 |
-1.7 |
0.752 |
0 |
0 |
0 |
0.007 |
33 |
41 |
|
[PO4]A:712 |
4 |
1 |
187 |
◊ |
[TDP]A:704 |
x,y,z |
1_555 |
7 |
1 |
597 |
33.4 |
-1.7 |
0.757 |
0 |
0 |
0 |
0.007 |
34 |
42 |
|
[GOL]A:705 |
4 |
1 |
220 |
◊ |
B |
-x+1,y,-z+1/2 |
3_655 |
6 |
3 |
24120 |
33.0 |
-0.3 |
0.517 |
0 |
0 |
0 |
0.000 |
35 |
43 |
|
[TDP]B:704 |
4 |
1 |
596 |
f |
[MG]B:703 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.3 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.017 |
44 |
|
[TDP]A:704 |
5 |
1 |
597 |
f |
[MG]A:703 |
x,y,z |
1_555 |
1 |
1 |
98 |
29.7 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.017 |
Average: |
30.0 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.017 |
36 |
45 |
|
[PO4]A:712 |
3 |
1 |
187 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
23737 |
28.0 |
-1.8 |
0.629 |
0 |
0 |
0 |
0.007 |
37 |
46 |
|
[PO4]B:710 |
3 |
1 |
187 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
24120 |
27.4 |
-1.8 |
0.646 |
0 |
0 |
0 |
0.007 |
38 |
47 |
|
[GOL]B:708 |
1 |
1 |
219 |
f |
[GOL]B:707 |
x,y,z |
1_555 |
3 |
1 |
218 |
11.3 |
0.1 |
0.479 |
0 |
0 |
0 |
0.000 |
39 |
48 |
|
[TDP]A:704 |
2 |
1 |
597 |
f |
[FAD]A:701 |
x,y,z |
1_555 |
1 |
1 |
999 |
8.1 |
-0.3 |
0.379 |
0 |
0 |
0 |
0.001 |
49 |
|
[TDP]B:704 |
2 |
1 |
596 |
f |
[FAD]B:701 |
x,y,z |
1_555 |
1 |
1 |
1001 |
8.0 |
-0.3 |
0.377 |
0 |
0 |
0 |
0.001 |
Average: |
8.0 |
-0.3 |
0.378 |
0 |
0 |
0 |
0.001 |
40 |
50 |
|
[GOL]A:710 |
1 |
1 |
219 |
f |
[GOL]A:709 |
x,y,z |
1_555 |
3 |
1 |
217 |
7.5 |
0.2 |
0.500 |
0 |
0 |
0 |
0.000 |
41 |
51 |
|
A |
2 |
2 |
23737 |
◊ |
A |
-x+1,y,-z+1/2 |
3_655 |
2 |
2 |
23737 |
6.3 |
-0.2 |
0.410 |
0 |
0 |
0 |
0.000 |
|