| ## |
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 |
|
E |
136 |
41 |
11912 |
◊ |
C |
x,y-1,z |
1_545 |
138 |
40 |
10949 |
1368.5 |
-19.3 |
0.208 |
15 |
7 |
0 |
0.546 |
2 |
|
F |
146 |
41 |
11859 |
◊ |
D |
x,y,z |
1_555 |
140 |
41 |
10711 |
1367.6 |
-18.2 |
0.242 |
15 |
7 |
0 |
0.546 |
3 |
|
C |
125 |
38 |
10949 |
◊ |
A |
x,y,z |
1_555 |
120 |
33 |
11967 |
1177.0 |
-14.3 |
0.388 |
10 |
7 |
0 |
0.546 |
4 |
|
D |
120 |
38 |
10711 |
◊ |
B |
x,y,z |
1_555 |
118 |
36 |
11943 |
1161.4 |
-14.4 |
0.353 |
9 |
7 |
0 |
0.546 |
5 |
|
E |
115 |
33 |
11912 |
◊ |
A |
x,y-1,z |
1_545 |
125 |
39 |
11967 |
1151.3 |
-14.3 |
0.375 |
10 |
7 |
0 |
0.546 |
6 |
|
F |
113 |
32 |
11859 |
◊ |
B |
x,y,z |
1_555 |
120 |
37 |
11943 |
1107.5 |
-12.9 |
0.403 |
10 |
7 |
0 |
0.546 |
| Average: |
1222.2 |
-15.6 |
0.328 |
12 |
7 |
0 |
0.546 |
| 2 |
7 |
|
E |
103 |
33 |
11912 |
◊ |
B |
x-1,y,z |
1_455 |
105 |
33 |
11943 |
1021.6 |
-14.1 |
0.348 |
11 |
2 |
0 |
0.376 |
| 3 |
8 |
|
A |
104 |
33 |
11967 |
◊ |
F |
x-1,y,z |
1_455 |
102 |
32 |
11859 |
978.9 |
-12.5 |
0.366 |
11 |
2 |
0 |
0.359 |
| 4 |
9 |
|
D |
47 |
14 |
10711 |
◊ |
B |
-x+1,y,-z |
2_655 |
51 |
15 |
11943 |
418.4 |
-0.8 |
0.851 |
8 |
0 |
0 |
0.052 |
10 |
|
C |
48 |
14 |
10949 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
44 |
13 |
11967 |
411.5 |
-1.2 |
0.806 |
7 |
0 |
0 |
0.052 |
11 |
|
F |
47 |
13 |
11859 |
◊ |
F |
-x+1,y,-z |
2_655 |
47 |
13 |
11859 |
407.6 |
-0.9 |
0.810 |
8 |
0 |
0 |
0.052 |
12 |
|
E |
46 |
14 |
11912 |
◊ |
E |
-x+1,y,-z+1 |
2_656 |
45 |
14 |
11912 |
382.2 |
-2.5 |
0.752 |
8 |
0 |
0 |
0.052 |
| Average: |
404.9 |
-1.4 |
0.805 |
8 |
0 |
0 |
0.052 |
| 5 |
13 |
|
A |
30 |
9 |
11967 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
30 |
9 |
11967 |
307.1 |
-4.1 |
0.402 |
10 |
0 |
0 |
0.086 |
14 |
|
B |
29 |
8 |
11943 |
◊ |
B |
-x+1,y,-z |
2_655 |
29 |
8 |
11943 |
306.3 |
-3.6 |
0.438 |
10 |
0 |
0 |
0.086 |
15 |
|
E |
25 |
7 |
11912 |
◊ |
C |
-x+1,y-1,-z+1 |
2_646 |
28 |
8 |
10949 |
284.5 |
-3.5 |
0.353 |
10 |
0 |
0 |
0.086 |
16 |
|
F |
25 |
8 |
11859 |
◊ |
D |
-x+1,y,-z |
2_655 |
28 |
7 |
10711 |
271.8 |
-1.7 |
0.635 |
9 |
0 |
0 |
0.086 |
| Average: |
292.4 |
-3.2 |
0.457 |
10 |
0 |
0 |
0.086 |
| 6 |
17 |
|
E |
30 |
10 |
11912 |
◊ |
D |
x,y,z |
1_555 |
31 |
10 |
10711 |
286.6 |
0.9 |
0.887 |
3 |
4 |
0 |
0.000 |
18 |
|
F |
29 |
11 |
11859 |
◊ |
C |
x,y,z |
1_555 |
31 |
12 |
10949 |
262.9 |
-0.3 |
0.796 |
3 |
4 |
0 |
0.000 |
| Average: |
274.8 |
0.3 |
0.841 |
3 |
4 |
0 |
0.000 |
| 7 |
19 |
|
C |
29 |
10 |
10949 |
◊ |
F |
x-1,y,z |
1_455 |
31 |
8 |
11859 |
278.6 |
-4.1 |
0.325 |
4 |
0 |
0 |
0.000 |
20 |
|
A |
29 |
8 |
11967 |
◊ |
B |
x-1,y,z |
1_455 |
27 |
9 |
11943 |
277.6 |
-4.5 |
0.300 |
4 |
0 |
0 |
0.000 |
21 |
|
E |
32 |
8 |
11912 |
◊ |
D |
x-1,y,z |
1_455 |
26 |
10 |
10711 |
265.8 |
-4.3 |
0.315 |
4 |
0 |
0 |
0.000 |
22 |
|
A |
27 |
9 |
11967 |
◊ |
B |
x-1,y+1,z |
1_465 |
29 |
7 |
11943 |
246.9 |
-3.0 |
0.465 |
4 |
0 |
0 |
0.000 |
| Average: |
267.2 |
-4.0 |
0.351 |
4 |
0 |
0 |
0.000 |
| 8 |
23 |
|
A |
22 |
8 |
11967 |
◊ |
A |
-x,y,-z+1 |
2_556 |
22 |
8 |
11967 |
188.1 |
4.4 |
0.989 |
2 |
0 |
0 |
0.000 |
| 9 |
24 |
|
[LMR]D:302 |
9 |
1 |
253 |
◊ |
D |
x,y,z |
1_555 |
16 |
7 |
10711 |
112.2 |
-0.7 |
0.691 |
3 |
0 |
0 |
0.049 |
25 |
|
E |
15 |
7 |
11912 |
◊ |
[LMR]A:303 |
x,y-1,z |
1_545 |
9 |
1 |
247 |
112.1 |
-0.6 |
0.680 |
3 |
0 |
0 |
0.049 |
26 |
|
[LMR]F:302 |
9 |
1 |
251 |
◊ |
F |
x,y,z |
1_555 |
14 |
7 |
11859 |
112.0 |
-0.6 |
0.658 |
3 |
0 |
0 |
0.049 |
27 |
|
[LMR]E:302 |
9 |
1 |
250 |
◊ |
C |
x,y-1,z |
1_545 |
15 |
7 |
10949 |
111.4 |
-0.8 |
0.659 |
3 |
0 |
0 |
0.049 |
28 |
|
[LMR]B:302 |
9 |
1 |
250 |
◊ |
B |
x,y,z |
1_555 |
15 |
7 |
11943 |
110.7 |
-0.5 |
0.679 |
3 |
0 |
0 |
0.049 |
29 |
|
[LMR]A:302 |
9 |
1 |
248 |
◊ |
A |
x,y,z |
1_555 |
16 |
7 |
11967 |
110.5 |
-0.5 |
0.686 |
3 |
0 |
0 |
0.049 |
| Average: |
111.5 |
-0.6 |
0.676 |
3 |
0 |
0 |
0.049 |
| 10 |
30 |
|
[LMR]D:302 |
8 |
1 |
253 |
f |
F |
x,y,z |
1_555 |
17 |
10 |
11859 |
103.5 |
-3.8 |
0.454 |
4 |
0 |
0 |
0.221 |
31 |
|
[LMR]E:302 |
8 |
1 |
250 |
f |
E |
x,y,z |
1_555 |
17 |
10 |
11912 |
101.9 |
-3.5 |
0.466 |
4 |
0 |
0 |
0.221 |
32 |
|
[LMR]B:302 |
8 |
1 |
250 |
f |
D |
x,y,z |
1_555 |
17 |
10 |
10711 |
101.1 |
-3.6 |
0.446 |
4 |
0 |
0 |
0.221 |
33 |
|
[LMR]A:303 |
8 |
1 |
247 |
f |
A |
x,y,z |
1_555 |
17 |
10 |
11967 |
100.7 |
-3.5 |
0.450 |
4 |
0 |
0 |
0.221 |
34 |
|
[LMR]F:302 |
8 |
1 |
251 |
f |
B |
x,y,z |
1_555 |
17 |
10 |
11943 |
100.7 |
-3.5 |
0.452 |
4 |
0 |
0 |
0.221 |
35 |
|
[LMR]A:302 |
8 |
1 |
248 |
f |
C |
x,y,z |
1_555 |
17 |
10 |
10949 |
100.1 |
-3.7 |
0.427 |
4 |
0 |
0 |
0.221 |
| Average: |
101.3 |
-3.6 |
0.449 |
4 |
0 |
0 |
0.221 |
| 11 |
36 |
|
[NA]B:301 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
9 |
6 |
11943 |
68.2 |
-11.0 |
0.000 |
0 |
0 |
0 |
0.419 |
37 |
|
[NA]C:301 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
9 |
6 |
10949 |
67.2 |
-10.7 |
0.000 |
0 |
0 |
0 |
0.419 |
38 |
|
[NA]A:301 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
11967 |
65.1 |
-10.4 |
0.000 |
0 |
0 |
0 |
0.419 |
39 |
|
[NA]F:301 |
1 |
1 |
125 |
f |
F |
x,y,z |
1_555 |
9 |
5 |
11859 |
64.9 |
-10.2 |
0.000 |
0 |
0 |
0 |
0.419 |
40 |
|
[NA]E:301 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
9 |
5 |
11912 |
64.9 |
-10.4 |
0.000 |
0 |
0 |
0 |
0.419 |
41 |
|
[NA]D:301 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
9 |
5 |
10711 |
64.8 |
-10.4 |
0.000 |
0 |
0 |
0 |
0.419 |
| Average: |
65.8 |
-10.5 |
0.000 |
0 |
0 |
0 |
0.419 |
| 12 |
42 |
|
E |
8 |
4 |
11912 |
◊ |
D |
-x+1,y,-z+1 |
2_656 |
9 |
5 |
10711 |
66.2 |
0.1 |
0.692 |
0 |
1 |
0 |
0.000 |
43 |
|
F |
3 |
2 |
11859 |
◊ |
C |
-x+1,y,-z |
2_655 |
3 |
2 |
10949 |
14.8 |
0.6 |
0.810 |
0 |
0 |
0 |
0.000 |
| Average: |
40.5 |
0.3 |
0.751 |
0 |
1 |
0 |
0.000 |
| 13 |
44 |
|
C |
6 |
4 |
10949 |
◊ |
C |
-x+1,y,-z+1 |
2_656 |
6 |
4 |
10949 |
35.1 |
-0.2 |
0.631 |
0 |
0 |
0 |
0.003 |
45 |
|
D |
5 |
1 |
10711 |
◊ |
D |
-x+1,y,-z |
2_655 |
5 |
1 |
10711 |
28.0 |
-0.4 |
0.517 |
0 |
0 |
0 |
0.003 |
46 |
|
E |
4 |
2 |
11912 |
◊ |
A |
-x+1,y-1,-z+1 |
2_646 |
4 |
2 |
11967 |
21.4 |
-0.2 |
0.584 |
0 |
0 |
0 |
0.003 |
47 |
|
F |
4 |
2 |
11859 |
◊ |
B |
-x+1,y,-z |
2_655 |
4 |
1 |
11943 |
19.2 |
-0.2 |
0.605 |
0 |
0 |
0 |
0.003 |
| Average: |
25.9 |
-0.3 |
0.584 |
0 |
0 |
0 |
0.003 |
| 14 |
48 |
|
F |
6 |
2 |
11859 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
4 |
3 |
11967 |
27.9 |
0.2 |
0.670 |
1 |
1 |
0 |
0.000 |
| 15 |
49 |
|
E |
2 |
2 |
11912 |
◊ |
B |
-x+1,y,-z |
2_655 |
2 |
1 |
11943 |
7.6 |
0.2 |
0.768 |
0 |
0 |
0 |
0.000 |
| 16 |
50 |
|
[NA]A:301 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
10949 |
7.4 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.015 |
51 |
|
[NA]B:301 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
10711 |
7.2 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.015 |
52 |
|
[NA]F:301 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
11943 |
7.1 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.015 |
53 |
|
[NA]D:301 |
1 |
1 |
125 |
◊ |
F |
x,y,z |
1_555 |
1 |
1 |
11859 |
6.9 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.015 |
54 |
|
E |
1 |
1 |
11912 |
◊ |
[NA]C:301 |
x,y-1,z |
1_545 |
1 |
1 |
125 |
6.9 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.015 |
55 |
|
[NA]E:301 |
1 |
1 |
125 |
◊ |
A |
x,y-1,z |
1_545 |
1 |
1 |
11967 |
6.2 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.015 |
| Average: |
6.9 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.015 |
|