| ## |
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 |
|
A |
122 |
34 |
12786 |
x |
A |
-y+1,x-y,z |
2_655 |
103 |
27 |
12786 |
1048.9 |
-8.3 |
0.385 |
19 |
12 |
0 |
0.608 |
2 |
|
C |
106 |
29 |
12933 |
x |
C |
-y+1,x-y,z |
2_655 |
106 |
30 |
12933 |
1038.3 |
-7.1 |
0.390 |
14 |
13 |
0 |
0.608 |
| Average: |
1043.6 |
-7.7 |
0.388 |
17 |
13 |
0 |
0.608 |
| 2 |
3 |
|
B |
72 |
17 |
8800 |
◊ |
A |
x,y,z |
1_555 |
92 |
28 |
12786 |
788.0 |
-2.9 |
0.528 |
20 |
9 |
0 |
0.538 |
4 |
|
D |
72 |
17 |
8721 |
◊ |
C |
x,y,z |
1_555 |
82 |
25 |
12933 |
737.3 |
-2.0 |
0.548 |
19 |
9 |
0 |
0.538 |
| Average: |
762.7 |
-2.4 |
0.538 |
20 |
9 |
0 |
0.538 |
| 3 |
5 |
|
D |
76 |
21 |
8721 |
◊ |
B |
x,y,z |
1_555 |
81 |
22 |
8800 |
762.2 |
-7.2 |
0.294 |
17 |
7 |
0 |
1.000 |
| 4 |
6 |
|
C |
32 |
12 |
12933 |
◊ |
C |
-x+2,-x+y+1,-z+1 |
6_766 |
31 |
12 |
12933 |
290.4 |
-1.2 |
0.562 |
4 |
0 |
0 |
0.000 |
| 5 |
7 |
|
D |
28 |
8 |
8721 |
◊ |
C |
y,x,-z+1 |
4_556 |
24 |
8 |
12933 |
260.4 |
1.3 |
0.651 |
4 |
4 |
0 |
0.000 |
| 6 |
8 |
|
B |
20 |
6 |
8800 |
x |
B |
-y+1,x-y+1,z |
2_665 |
17 |
6 |
8800 |
152.0 |
0.0 |
0.513 |
0 |
2 |
0 |
0.000 |
| 7 |
9 |
|
A |
16 |
4 |
12786 |
◊ |
C |
-y+1,x-y,z |
2_655 |
20 |
4 |
12933 |
149.0 |
-2.4 |
0.265 |
0 |
0 |
0 |
0.023 |
| 8 |
10 |
|
[PCT]A:311 |
8 |
1 |
258 |
f |
A |
x,y,z |
1_555 |
27 |
14 |
12786 |
129.8 |
-4.0 |
0.642 |
13 |
0 |
0 |
0.403 |
| 9 |
11 |
|
[MAL]A:312 |
7 |
1 |
235 |
◊ |
A |
x,y,z |
1_555 |
25 |
11 |
12786 |
127.9 |
2.9 |
0.666 |
4 |
0 |
0 |
0.000 |
| 10 |
12 |
|
[PCT]C:311 |
8 |
1 |
256 |
f |
C |
x,y,z |
1_555 |
27 |
14 |
12933 |
127.0 |
-4.1 |
0.651 |
16 |
0 |
0 |
0.377 |
| 11 |
13 |
|
A |
17 |
5 |
12786 |
◊ |
A |
y,x,-z |
4_555 |
17 |
5 |
12786 |
124.2 |
1.9 |
0.904 |
0 |
0 |
0 |
0.000 |
| 12 |
14 |
|
[MAL]C:312 |
7 |
1 |
232 |
◊ |
C |
x,y,z |
1_555 |
24 |
11 |
12933 |
123.4 |
2.5 |
0.652 |
4 |
0 |
0 |
0.000 |
| 13 |
15 |
|
A |
8 |
2 |
12786 |
◊ |
B |
-x+1,-x+y,-z |
6_655 |
11 |
4 |
8800 |
114.5 |
-1.1 |
0.347 |
1 |
0 |
0 |
0.000 |
| 14 |
16 |
|
B |
7 |
3 |
8800 |
◊ |
A |
y,x,-z |
4_555 |
8 |
3 |
12786 |
72.9 |
1.5 |
0.870 |
3 |
6 |
0 |
0.000 |
| 15 |
17 |
|
[PCT]A:311 |
5 |
1 |
258 |
◊ |
[MAL]A:312 |
x,y,z |
1_555 |
6 |
1 |
235 |
41.9 |
0.5 |
0.563 |
0 |
0 |
0 |
0.000 |
| 16 |
18 |
|
[PCT]C:311 |
5 |
1 |
256 |
◊ |
[MAL]C:312 |
x,y,z |
1_555 |
5 |
1 |
232 |
41.6 |
0.5 |
0.599 |
0 |
0 |
0 |
0.000 |
| 17 |
19 |
|
C |
5 |
2 |
12933 |
◊ |
D |
-y+2,x-y+1,z |
2_765 |
3 |
1 |
8721 |
37.2 |
1.2 |
0.909 |
2 |
2 |
0 |
0.000 |
| 18 |
20 |
|
C |
5 |
3 |
12933 |
◊ |
[PCT]C:311 |
-y+1,x-y,z |
2_655 |
5 |
1 |
256 |
36.6 |
-2.1 |
0.554 |
2 |
0 |
0 |
0.101 |
| 19 |
21 |
|
[PCT]A:311 |
3 |
1 |
258 |
◊ |
A |
-y+1,x-y,z |
2_655 |
5 |
3 |
12786 |
35.0 |
-1.9 |
0.512 |
1 |
0 |
0 |
0.078 |
| 20 |
22 |
|
C |
3 |
1 |
12933 |
f |
[MAL]C:312 |
-y+1,x-y,z |
2_655 |
3 |
1 |
232 |
31.8 |
-1.5 |
0.145 |
0 |
0 |
0 |
0.051 |
| 21 |
23 |
|
[MAL]A:312 |
4 |
1 |
235 |
f |
A |
-y+1,x-y,z |
2_655 |
5 |
1 |
12786 |
30.4 |
-1.4 |
0.180 |
0 |
0 |
0 |
0.059 |
| 22 |
24 |
|
A |
3 |
1 |
12786 |
◊ |
B |
-y+1,x-y,z |
2_655 |
2 |
1 |
8800 |
24.5 |
-0.7 |
0.216 |
0 |
0 |
0 |
0.013 |
25 |
|
D |
2 |
1 |
8721 |
◊ |
C |
-y+1,x-y,z |
2_655 |
3 |
1 |
12933 |
20.3 |
-0.6 |
0.253 |
0 |
0 |
0 |
0.013 |
| Average: |
22.4 |
-0.7 |
0.234 |
0 |
0 |
0 |
0.013 |
|