| ## |
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 |
50 |
11 |
13529 |
◊ |
A |
-x,y-1/2,-z-1/2 |
3_544 |
46 |
14 |
13165 |
427.6 |
0.8 |
0.686 |
7 |
4 |
0 |
0.000 |
| 2 |
2 |
|
B |
41 |
13 |
13529 |
◊ |
A |
x,y,z |
1_555 |
41 |
14 |
13165 |
383.2 |
0.9 |
0.707 |
4 |
2 |
0 |
0.000 |
| 3 |
3 |
|
B |
43 |
12 |
13529 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
39 |
9 |
13165 |
350.9 |
-0.3 |
0.603 |
6 |
1 |
0 |
0.000 |
| 4 |
4 |
|
A |
32 |
8 |
13165 |
◊ |
B |
-x,y-1/2,-z-1/2 |
3_544 |
38 |
13 |
13529 |
328.9 |
-2.6 |
0.313 |
5 |
1 |
0 |
0.000 |
| 5 |
5 |
|
A |
23 |
8 |
13165 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
32 |
10 |
13529 |
249.3 |
-4.0 |
0.133 |
1 |
0 |
0 |
0.000 |
| 6 |
6 |
|
B |
23 |
11 |
13529 |
x |
B |
-x,y-1/2,-z-1/2 |
3_544 |
26 |
9 |
13529 |
228.6 |
-1.9 |
0.320 |
0 |
0 |
0 |
0.000 |
| 7 |
7 |
|
[MAN]B:502 |
11 |
1 |
290 |
f |
B |
x,y,z |
1_555 |
26 |
12 |
13529 |
145.1 |
2.7 |
0.417 |
1 |
0 |
0 |
0.000 |
8 |
|
[MAN]A:502 |
11 |
1 |
288 |
f |
A |
x,y,z |
1_555 |
25 |
11 |
13165 |
144.9 |
2.7 |
0.437 |
1 |
0 |
0 |
0.000 |
| Average: |
145.0 |
2.7 |
0.427 |
1 |
0 |
0 |
0.000 |
| 8 |
9 |
|
[MAN]A:503 |
11 |
1 |
290 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
13165 |
136.4 |
2.8 |
0.334 |
2 |
0 |
0 |
0.000 |
10 |
|
[MAN]B:503 |
11 |
1 |
291 |
f |
B |
x,y,z |
1_555 |
16 |
7 |
13529 |
134.5 |
2.7 |
0.330 |
2 |
0 |
0 |
0.000 |
| Average: |
135.4 |
2.7 |
0.332 |
2 |
0 |
0 |
0.000 |
| 9 |
11 |
|
[BMA]B:500B |
11 |
1 |
303 |
f |
B |
x,y,z |
1_555 |
25 |
8 |
13529 |
127.9 |
1.8 |
0.436 |
2 |
0 |
0 |
0.000 |
12 |
|
[BMA]A:500B |
11 |
1 |
302 |
f |
A |
x,y,z |
1_555 |
23 |
8 |
13165 |
122.2 |
1.7 |
0.417 |
2 |
0 |
0 |
0.000 |
| Average: |
125.1 |
1.7 |
0.426 |
2 |
0 |
0 |
0.000 |
| 10 |
13 |
|
A |
14 |
6 |
13165 |
x |
A |
x-1/2,-y-1/2,-z |
4_445 |
12 |
5 |
13165 |
127.8 |
-1.5 |
0.258 |
0 |
0 |
0 |
0.000 |
| 11 |
14 |
|
[MAN]B:501 |
11 |
1 |
292 |
f |
B |
x,y,z |
1_555 |
27 |
11 |
13529 |
126.6 |
1.7 |
0.370 |
4 |
0 |
0 |
0.000 |
15 |
|
[MAN]A:501 |
11 |
1 |
291 |
f |
A |
x,y,z |
1_555 |
26 |
11 |
13165 |
126.1 |
1.7 |
0.366 |
4 |
0 |
0 |
0.000 |
| Average: |
126.4 |
1.7 |
0.368 |
4 |
0 |
0 |
0.000 |
| 12 |
16 |
|
[MAN]A:500A |
11 |
1 |
299 |
f |
A |
x,y,z |
1_555 |
23 |
8 |
13165 |
120.4 |
1.7 |
0.450 |
2 |
0 |
0 |
0.000 |
17 |
|
[MAN]B:500A |
11 |
1 |
298 |
f |
B |
x,y,z |
1_555 |
25 |
8 |
13529 |
116.6 |
1.4 |
0.409 |
2 |
0 |
0 |
0.000 |
| Average: |
118.5 |
1.6 |
0.429 |
2 |
0 |
0 |
0.000 |
| 13 |
18 |
|
[MAN]A:504 |
9 |
1 |
293 |
f |
A |
x,y,z |
1_555 |
19 |
8 |
13165 |
109.2 |
2.2 |
0.339 |
0 |
0 |
0 |
0.000 |
19 |
|
[MAN]B:504 |
9 |
1 |
292 |
f |
B |
x,y,z |
1_555 |
18 |
7 |
13529 |
108.0 |
2.2 |
0.360 |
0 |
0 |
0 |
0.000 |
| Average: |
108.6 |
2.2 |
0.350 |
0 |
0 |
0 |
0.000 |
| 14 |
20 |
|
[MAN]A:500A |
12 |
1 |
299 |
f |
[BMA]A:500B |
x,y,z |
1_555 |
12 |
1 |
302 |
105.1 |
3.2 |
0.195 |
0 |
0 |
0 |
0.000 |
21 |
|
[MAN]B:500A |
12 |
1 |
298 |
f |
[BMA]B:500B |
x,y,z |
1_555 |
12 |
1 |
303 |
104.1 |
3.0 |
0.185 |
0 |
0 |
0 |
0.000 |
| Average: |
104.6 |
3.1 |
0.190 |
0 |
0 |
0 |
0.000 |
| 15 |
22 |
|
B |
9 |
2 |
13529 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
9 |
3 |
13165 |
81.4 |
1.9 |
0.870 |
2 |
1 |
0 |
0.000 |
| 16 |
23 |
|
[MAN]B:504 |
7 |
1 |
292 |
cf |
[MAN]B:503 |
x,y,z |
1_555 |
6 |
1 |
291 |
60.4 |
2.4 |
0.196 |
0 |
0 |
0 |
0.000 |
24 |
|
[MAN]A:504 |
6 |
1 |
293 |
cf |
[MAN]A:503 |
x,y,z |
1_555 |
6 |
1 |
290 |
59.8 |
2.4 |
0.214 |
0 |
0 |
0 |
0.000 |
| Average: |
60.1 |
2.4 |
0.205 |
0 |
0 |
0 |
0.000 |
| 17 |
25 |
|
[MAN]A:503 |
7 |
1 |
290 |
cf |
[MAN]A:502 |
x,y,z |
1_555 |
5 |
1 |
288 |
54.4 |
2.5 |
0.247 |
0 |
0 |
0 |
0.000 |
26 |
|
[MAN]B:503 |
7 |
1 |
291 |
cf |
[MAN]B:502 |
x,y,z |
1_555 |
5 |
1 |
290 |
54.2 |
2.4 |
0.233 |
0 |
0 |
0 |
0.000 |
| Average: |
54.3 |
2.4 |
0.240 |
0 |
0 |
0 |
0.000 |
| 18 |
27 |
|
[MAN]B:501 |
6 |
1 |
292 |
cf |
[BMA]B:500B |
x,y,z |
1_555 |
4 |
1 |
303 |
45.3 |
1.5 |
0.287 |
0 |
0 |
0 |
0.000 |
28 |
|
[MAN]A:501 |
6 |
1 |
291 |
cf |
[BMA]A:500B |
x,y,z |
1_555 |
4 |
1 |
302 |
43.7 |
1.5 |
0.315 |
0 |
0 |
0 |
0.000 |
| Average: |
44.5 |
1.5 |
0.301 |
0 |
0 |
0 |
0.000 |
| 19 |
29 |
|
[MAN]A:501 |
6 |
1 |
291 |
cf |
[MAN]A:500A |
x,y,z |
1_555 |
4 |
1 |
299 |
44.2 |
1.6 |
0.335 |
0 |
0 |
0 |
0.000 |
30 |
|
[MAN]B:501 |
6 |
1 |
292 |
cf |
[MAN]B:500A |
x,y,z |
1_555 |
4 |
1 |
298 |
43.0 |
1.6 |
0.355 |
0 |
0 |
0 |
0.000 |
| Average: |
43.6 |
1.6 |
0.345 |
0 |
0 |
0 |
0.000 |
| 20 |
31 |
|
[MAN]B:502 |
7 |
1 |
290 |
cf |
[MAN]B:501 |
x,y,z |
1_555 |
4 |
1 |
292 |
42.5 |
1.8 |
0.232 |
0 |
0 |
0 |
0.000 |
32 |
|
[MAN]A:502 |
7 |
1 |
288 |
cf |
[MAN]A:501 |
x,y,z |
1_555 |
4 |
1 |
291 |
42.2 |
1.8 |
0.246 |
0 |
0 |
0 |
0.000 |
| Average: |
42.4 |
1.8 |
0.239 |
0 |
0 |
0 |
0.000 |
| 21 |
33 |
|
B |
2 |
1 |
13529 |
x |
B |
x-1/2,-y-1/2,-z-1 |
4_444 |
1 |
1 |
13529 |
21.5 |
-0.7 |
0.117 |
0 |
0 |
0 |
0.000 |
| 22 |
34 |
|
[MAN]B:504 |
1 |
1 |
292 |
f |
[MAN]B:502 |
x,y,z |
1_555 |
2 |
1 |
290 |
7.2 |
0.4 |
0.260 |
0 |
0 |
0 |
0.000 |
35 |
|
[MAN]A:504 |
1 |
1 |
293 |
f |
[MAN]A:502 |
x,y,z |
1_555 |
2 |
1 |
288 |
6.6 |
0.4 |
0.269 |
0 |
0 |
0 |
0.000 |
| Average: |
6.9 |
0.4 |
0.264 |
0 |
0 |
0 |
0.000 |
| 23 |
36 |
|
[MAN]B:502 |
1 |
1 |
290 |
f |
[BMA]B:500B |
x,y,z |
1_555 |
2 |
1 |
303 |
6.7 |
0.1 |
0.268 |
0 |
0 |
0 |
0.000 |
37 |
|
[MAN]A:502 |
1 |
1 |
288 |
f |
[BMA]A:500B |
x,y,z |
1_555 |
2 |
1 |
302 |
6.5 |
0.2 |
0.268 |
0 |
0 |
0 |
0.000 |
| Average: |
6.6 |
0.2 |
0.268 |
0 |
0 |
0 |
0.000 |
| 24 |
38 |
|
[MAN]B:502 |
1 |
1 |
290 |
f |
[MAN]B:500A |
x,y,z |
1_555 |
2 |
1 |
298 |
6.2 |
0.2 |
0.275 |
0 |
0 |
0 |
0.000 |
39 |
|
[MAN]A:502 |
1 |
1 |
288 |
f |
[MAN]A:500A |
x,y,z |
1_555 |
2 |
1 |
299 |
6.1 |
0.2 |
0.254 |
0 |
0 |
0 |
0.000 |
| Average: |
6.2 |
0.2 |
0.265 |
0 |
0 |
0 |
0.000 |
|