| ## |
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 |
112 |
31 |
11058 |
◊ |
B |
-y,x-y,z |
2_555 |
113 |
31 |
10793 |
1155.4 |
-14.6 |
0.148 |
8 |
6 |
0 |
0.142 |
| 2 |
2 |
|
B |
35 |
9 |
10793 |
◊ |
A |
-y+1,x-y+1,z |
2_665 |
38 |
12 |
11058 |
332.1 |
-2.6 |
0.506 |
1 |
0 |
0 |
0.000 |
| 3 |
3 |
|
[ADP]B:311 |
26 |
1 |
542 |
f |
B |
x,y,z |
1_555 |
40 |
15 |
10793 |
304.1 |
-0.4 |
0.832 |
4 |
0 |
0 |
0.016 |
| 4 |
4 |
|
[AMP]A:308 |
22 |
1 |
493 |
f |
A |
x,y,z |
1_555 |
37 |
14 |
11058 |
284.3 |
0.4 |
0.681 |
3 |
0 |
0 |
0.007 |
| 5 |
5 |
|
[AMP]A:309 |
22 |
1 |
483 |
f |
A |
x,y,z |
1_555 |
46 |
16 |
11058 |
275.1 |
0.2 |
0.710 |
8 |
0 |
0 |
0.057 |
6 |
|
[AMP]B:312 |
22 |
1 |
477 |
f |
B |
x,y,z |
1_555 |
43 |
15 |
10793 |
274.4 |
0.5 |
0.720 |
11 |
0 |
0 |
0.057 |
| Average: |
274.8 |
0.4 |
0.715 |
10 |
0 |
0 |
0.057 |
| 6 |
7 |
|
B |
34 |
13 |
10793 |
◊ |
A |
x,y,z |
1_555 |
31 |
11 |
11058 |
266.0 |
-0.0 |
0.746 |
3 |
3 |
0 |
0.014 |
| 7 |
8 |
|
A |
18 |
4 |
11058 |
x |
A |
-x+y-1/3,-x+1/3,z+1/3 |
6_455 |
13 |
7 |
11058 |
176.3 |
-2.0 |
0.293 |
1 |
0 |
0 |
0.000 |
| 8 |
9 |
|
B |
12 |
5 |
10793 |
x |
B |
-y+2/3,x-y+1/3,z+1/3 |
5_555 |
18 |
7 |
10793 |
163.8 |
-1.8 |
0.381 |
1 |
0 |
0 |
0.000 |
| 9 |
10 |
|
[BU1]B:310 |
6 |
1 |
238 |
f |
B |
x,y,z |
1_555 |
19 |
4 |
10793 |
136.6 |
-0.1 |
0.306 |
1 |
0 |
0 |
0.004 |
| 10 |
11 |
|
[BU1]A:310 |
6 |
1 |
235 |
◊ |
A |
x,y,z |
1_555 |
19 |
4 |
11058 |
134.6 |
2.4 |
0.403 |
0 |
0 |
0 |
0.000 |
| 11 |
12 |
|
B |
16 |
6 |
10793 |
◊ |
A |
-x+y-1/3,-x+1/3,z+1/3 |
6_455 |
11 |
4 |
11058 |
126.8 |
0.1 |
0.700 |
1 |
0 |
0 |
0.000 |
| 12 |
13 |
|
B |
15 |
8 |
10793 |
◊ |
A |
-y+2/3,x-y+1/3,z+1/3 |
5_555 |
14 |
5 |
11058 |
117.4 |
3.1 |
0.949 |
1 |
1 |
0 |
0.000 |
| 13 |
14 |
|
[CD]A:304 |
1 |
1 |
112 |
f |
A |
x,y,z |
1_555 |
10 |
3 |
11058 |
62.4 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.105 |
15 |
|
[CD]B:304 |
1 |
1 |
112 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
10793 |
58.9 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.105 |
| Average: |
60.7 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.105 |
| 14 |
16 |
|
[CD]B:303 |
1 |
1 |
112 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
10793 |
60.5 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.091 |
17 |
|
[CD]A:303 |
1 |
1 |
112 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
11058 |
53.2 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.091 |
| Average: |
56.8 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.091 |
| 15 |
18 |
|
B |
9 |
5 |
10793 |
◊ |
A |
x+2/3,y+1/3,z+1/3 |
4_555 |
8 |
4 |
11058 |
60.2 |
0.2 |
0.714 |
0 |
0 |
0 |
0.000 |
| 16 |
19 |
|
[CD]B:305 |
1 |
1 |
112 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
10793 |
51.6 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.040 |
| 17 |
20 |
|
[CD]B:306 |
1 |
1 |
112 |
f |
A |
-y+2/3,x-y+1/3,z+1/3 |
5_555 |
6 |
3 |
11058 |
50.1 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.042 |
| 18 |
21 |
|
[CD]B:308 |
1 |
1 |
112 |
f |
B |
x,y,z |
1_555 |
14 |
5 |
10793 |
44.4 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.073 |
22 |
|
[CD]A:306 |
1 |
1 |
112 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
11058 |
43.8 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.073 |
| Average: |
44.1 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.073 |
| 19 |
23 |
|
[CD]B:307 |
1 |
1 |
112 |
f |
B |
x,y,z |
1_555 |
8 |
3 |
10793 |
43.5 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.029 |
| 20 |
24 |
|
[AMP]B:312 |
7 |
1 |
477 |
f |
[CD]B:308 |
x,y,z |
1_555 |
1 |
1 |
112 |
42.8 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.055 |
25 |
|
[AMP]A:309 |
5 |
1 |
483 |
f |
[CD]A:306 |
x,y,z |
1_555 |
1 |
1 |
112 |
38.7 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.055 |
| Average: |
40.8 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.055 |
| 21 |
26 |
|
A |
5 |
3 |
11058 |
◊ |
[BU1]B:310 |
-y,x-y,z |
2_555 |
4 |
1 |
238 |
42.7 |
1.2 |
0.469 |
1 |
0 |
0 |
0.000 |
| 22 |
27 |
|
[BU1]A:310 |
3 |
1 |
235 |
f |
B |
-y,x-y,z |
2_555 |
5 |
3 |
10793 |
42.2 |
1.6 |
0.582 |
0 |
0 |
0 |
0.000 |
| 23 |
28 |
|
[CD]A:307 |
1 |
1 |
112 |
f |
A |
x,y,z |
1_555 |
12 |
7 |
11058 |
41.9 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.054 |
29 |
|
[CD]B:309 |
1 |
1 |
112 |
f |
B |
x,y,z |
1_555 |
11 |
7 |
10793 |
39.7 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.054 |
30 |
|
[CD]A:311 |
1 |
1 |
112 |
f |
A |
x,y,z |
1_555 |
7 |
5 |
11058 |
22.5 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.054 |
| Average: |
34.7 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.054 |
| 24 |
31 |
|
[CD]A:301 |
1 |
1 |
112 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
10793 |
41.2 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.063 |
32 |
|
[CD]A:301 |
1 |
1 |
112 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
11058 |
41.1 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.063 |
| Average: |
41.2 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.063 |
| 25 |
33 |
|
[CD]A:302 |
1 |
1 |
112 |
f |
B |
x,y,z |
1_555 |
3 |
1 |
10793 |
38.1 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.038 |
34 |
|
[CD]B:302 |
1 |
1 |
112 |
f |
A |
x,y,z |
1_555 |
3 |
1 |
11058 |
23.7 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.038 |
| Average: |
30.9 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.038 |
| 26 |
35 |
|
[AMP]A:309 |
3 |
1 |
483 |
f |
[CD]A:311 |
x,y,z |
1_555 |
1 |
1 |
112 |
37.5 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.045 |
36 |
|
[AMP]B:312 |
4 |
1 |
477 |
f |
[CD]B:301 |
x,y,z |
1_555 |
1 |
1 |
112 |
36.7 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.045 |
| Average: |
37.1 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.045 |
| 27 |
37 |
|
[ADP]B:311 |
6 |
1 |
542 |
f |
[CD]B:309 |
x,y,z |
1_555 |
1 |
1 |
112 |
37.5 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.037 |
| 28 |
38 |
|
[CD]B:302 |
1 |
1 |
112 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
10793 |
37.2 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.039 |
39 |
|
[CD]A:302 |
1 |
1 |
112 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
11058 |
37.1 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.039 |
| Average: |
37.2 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.039 |
| 29 |
40 |
|
[CD]A:305 |
1 |
1 |
112 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
11058 |
36.1 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.025 |
| 30 |
41 |
|
[CD]B:306 |
1 |
1 |
112 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
10793 |
35.8 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.000 |
| 31 |
42 |
|
[AMP]A:308 |
6 |
1 |
493 |
f |
[CD]A:307 |
x,y,z |
1_555 |
1 |
1 |
112 |
34.2 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.029 |
| 32 |
43 |
|
[AMP]A:309 |
1 |
1 |
483 |
f |
[CD]A:303 |
x,y,z |
1_555 |
1 |
1 |
112 |
25.0 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.019 |
44 |
|
[AMP]B:312 |
1 |
1 |
477 |
f |
[CD]B:303 |
x,y,z |
1_555 |
1 |
1 |
112 |
18.8 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.019 |
| Average: |
21.9 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.019 |
| 33 |
45 |
|
[CD]A:311 |
1 |
1 |
112 |
f |
[CD]A:307 |
x,y,z |
1_555 |
1 |
1 |
112 |
24.1 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.029 |
| 34 |
46 |
|
[CD]B:309 |
1 |
1 |
112 |
f |
[CD]B:301 |
x,y,z |
1_555 |
1 |
1 |
112 |
22.3 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.027 |
| 35 |
47 |
|
[CD]B:301 |
1 |
1 |
112 |
f |
B |
x,y,z |
1_555 |
6 |
4 |
10793 |
20.7 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.015 |
| 36 |
48 |
|
[ADP]B:311 |
4 |
1 |
542 |
f |
[CD]B:301 |
x,y,z |
1_555 |
1 |
1 |
112 |
18.1 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.018 |
| 37 |
49 |
|
[AMP]A:308 |
1 |
1 |
493 |
f |
[CD]A:311 |
x,y,z |
1_555 |
1 |
1 |
112 |
11.2 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.011 |
| 38 |
50 |
|
[AMP]A:309 |
3 |
1 |
483 |
f |
[CD]A:307 |
x,y,z |
1_555 |
1 |
1 |
112 |
10.6 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.009 |
51 |
|
[AMP]B:312 |
3 |
1 |
477 |
f |
[CD]B:309 |
x,y,z |
1_555 |
1 |
1 |
112 |
9.1 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.009 |
| Average: |
9.8 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.009 |
| 39 |
52 |
|
[CD]A:306 |
1 |
1 |
112 |
f |
[CD]A:303 |
x,y,z |
1_555 |
1 |
1 |
112 |
7.7 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.009 |
| 40 |
53 |
|
[CD]A:311 |
1 |
1 |
112 |
f |
[CD]A:303 |
x,y,z |
1_555 |
1 |
1 |
112 |
5.5 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.007 |
| 41 |
54 |
|
[ADP]B:311 |
2 |
1 |
542 |
f |
[CD]B:303 |
x,y,z |
1_555 |
1 |
1 |
112 |
3.1 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.003 |
| 42 |
55 |
|
[CD]B:303 |
1 |
1 |
112 |
f |
[CD]B:301 |
x,y,z |
1_555 |
1 |
1 |
112 |
2.5 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.003 |
|