| ## |
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 |
199 |
52 |
15522 |
◊ |
A |
x,y,z |
1_555 |
208 |
55 |
15739 |
1914.6 |
-20.8 |
0.081 |
17 |
2 |
0 |
0.444 |
| 2 |
2 |
|
B |
60 |
19 |
15522 |
◊ |
B |
-x+1,y,-z+1 |
2_656 |
60 |
19 |
15522 |
486.2 |
-5.0 |
0.334 |
1 |
0 |
0 |
0.000 |
| 3 |
3 |
|
B |
49 |
16 |
15522 |
◊ |
B |
-x+2,y,-z+1 |
2_756 |
49 |
16 |
15522 |
467.3 |
0.6 |
0.745 |
2 |
14 |
0 |
0.000 |
4 |
|
A |
45 |
15 |
15739 |
◊ |
A |
-x,y,-z |
2_555 |
45 |
15 |
15739 |
370.5 |
-1.3 |
0.563 |
2 |
8 |
0 |
0.000 |
| Average: |
418.9 |
-0.3 |
0.654 |
2 |
11 |
0 |
0.000 |
| 4 |
5 |
|
[ATP]B:402 |
30 |
1 |
590 |
f |
B |
x,y,z |
1_555 |
55 |
26 |
15522 |
387.2 |
-2.3 |
0.536 |
11 |
0 |
0 |
0.231 |
6 |
|
[ATP]A:402 |
30 |
1 |
590 |
f |
A |
x,y,z |
1_555 |
60 |
26 |
15739 |
386.5 |
-1.9 |
0.559 |
13 |
0 |
0 |
0.231 |
| Average: |
386.9 |
-2.1 |
0.548 |
12 |
0 |
0 |
0.231 |
| 5 |
7 |
|
A |
37 |
11 |
15739 |
◊ |
B |
x-1/2,y+1/2,z |
3_455 |
42 |
12 |
15522 |
355.2 |
1.4 |
0.764 |
1 |
3 |
0 |
0.000 |
| 6 |
8 |
|
[5BX]B:401 |
19 |
1 |
447 |
f |
B |
x,y,z |
1_555 |
48 |
18 |
15522 |
274.1 |
-2.2 |
0.525 |
1 |
0 |
0 |
0.088 |
9 |
|
[5BX]A:401 |
19 |
1 |
450 |
f |
A |
x,y,z |
1_555 |
47 |
17 |
15739 |
273.2 |
-2.6 |
0.481 |
1 |
0 |
0 |
0.088 |
| Average: |
273.7 |
-2.4 |
0.503 |
1 |
0 |
0 |
0.088 |
| 7 |
10 |
|
A |
17 |
4 |
15739 |
x |
A |
x-1,y,z |
1_455 |
15 |
6 |
15739 |
149.9 |
-1.4 |
0.365 |
1 |
0 |
0 |
0.000 |
| 8 |
11 |
|
A |
20 |
7 |
15739 |
◊ |
B |
x-1,y,z |
1_455 |
14 |
5 |
15522 |
140.6 |
1.6 |
0.794 |
0 |
0 |
0 |
0.000 |
| 9 |
12 |
|
B |
9 |
2 |
15522 |
x |
B |
x-1/2,y-1/2,z |
3_445 |
17 |
5 |
15522 |
107.5 |
1.0 |
0.789 |
1 |
2 |
0 |
0.000 |
| 10 |
13 |
|
A |
13 |
5 |
15739 |
x |
A |
x-1/2,y+1/2,z |
3_455 |
13 |
5 |
15739 |
98.8 |
0.5 |
0.615 |
0 |
1 |
0 |
0.000 |
| 11 |
14 |
|
[GOL]B:405 |
5 |
1 |
218 |
f |
B |
x,y,z |
1_555 |
19 |
7 |
15522 |
96.5 |
-0.9 |
0.438 |
0 |
0 |
0 |
0.014 |
| 12 |
15 |
|
[GOL]B:406 |
6 |
1 |
218 |
f |
B |
x,y,z |
1_555 |
13 |
3 |
15522 |
93.2 |
-0.7 |
0.528 |
3 |
0 |
0 |
0.031 |
| 13 |
16 |
|
[GOL]B:405 |
5 |
1 |
218 |
◊ |
A |
x,y,z |
1_555 |
16 |
5 |
15739 |
81.9 |
-0.8 |
0.432 |
0 |
0 |
0 |
0.012 |
| 14 |
17 |
|
[ATP]A:402 |
10 |
1 |
590 |
f |
[5BX]A:401 |
x,y,z |
1_555 |
7 |
1 |
450 |
64.7 |
0.3 |
0.639 |
0 |
0 |
0 |
0.000 |
18 |
|
[ATP]B:402 |
10 |
1 |
590 |
f |
[5BX]B:401 |
x,y,z |
1_555 |
7 |
1 |
447 |
60.4 |
0.4 |
0.649 |
0 |
0 |
0 |
0.000 |
| Average: |
62.6 |
0.4 |
0.644 |
0 |
0 |
0 |
0.000 |
| 15 |
19 |
|
[MN]B:404 |
1 |
1 |
123 |
f |
[MN]B:404 |
-x+2,y,-z+1 |
2_756 |
1 |
1 |
123 |
58.1 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.100 |
| 16 |
20 |
|
[MN]B:403 |
1 |
1 |
123 |
f |
B |
x,y,z |
1_555 |
10 |
9 |
15522 |
51.7 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.054 |
21 |
|
[MN]A:403 |
1 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
8 |
7 |
15739 |
45.8 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.054 |
| Average: |
48.8 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.054 |
| 17 |
22 |
|
[MN]A:404 |
1 |
1 |
123 |
x |
A |
x,y,z |
1_555 |
7 |
3 |
15739 |
49.8 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.000 |
23 |
|
[MN]B:404 |
1 |
1 |
123 |
x |
B |
x,y,z |
1_555 |
6 |
3 |
15522 |
43.4 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.000 |
| Average: |
46.6 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.000 |
| 18 |
24 |
|
[MN]A:403 |
1 |
1 |
123 |
f |
[ATP]A:402 |
x,y,z |
1_555 |
7 |
1 |
590 |
44.4 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.112 |
25 |
|
[MN]B:403 |
1 |
1 |
123 |
f |
[ATP]B:402 |
x,y,z |
1_555 |
7 |
1 |
590 |
43.4 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.112 |
| Average: |
43.9 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.112 |
| 19 |
26 |
|
B |
2 |
1 |
15522 |
◊ |
A |
x-1/2,y-1/2,z |
3_445 |
5 |
1 |
15739 |
26.3 |
0.1 |
0.647 |
0 |
0 |
0 |
0.000 |
| 20 |
27 |
|
[MN]A:403 |
1 |
1 |
123 |
f |
[5BX]A:401 |
x,y,z |
1_555 |
4 |
1 |
450 |
21.1 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.025 |
28 |
|
[MN]B:403 |
1 |
1 |
123 |
f |
[5BX]B:401 |
x,y,z |
1_555 |
4 |
1 |
447 |
19.6 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.025 |
| Average: |
20.3 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.025 |
| 21 |
29 |
|
A |
2 |
1 |
15739 |
x |
A |
x-1/2,y-1/2,z |
3_445 |
2 |
2 |
15739 |
7.6 |
0.2 |
0.752 |
0 |
0 |
0 |
0.000 |
|