## |
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 |
77 |
24 |
10268 |
◊ |
A |
x,y,z |
1_555 |
76 |
25 |
10098 |
678.0 |
-2.2 |
0.414 |
10 |
0 |
0 |
0.000 |
2 |
2 |
|
B |
43 |
14 |
10268 |
◊ |
A |
-x-1/2,y-1/2,-z |
4_445 |
41 |
15 |
10098 |
347.8 |
0.5 |
0.591 |
2 |
2 |
0 |
0.000 |
3 |
3 |
|
A |
34 |
11 |
10098 |
◊ |
A |
-x,y,-z |
2_555 |
34 |
11 |
10098 |
249.1 |
-1.1 |
0.431 |
0 |
0 |
0 |
0.000 |
4 |
4 |
|
[BGC]B:304 |
12 |
1 |
304 |
◊ |
B |
x,y,z |
1_555 |
38 |
14 |
10268 |
197.8 |
3.4 |
0.485 |
4 |
0 |
0 |
0.000 |
5 |
|
[BGC]A:303 |
12 |
1 |
303 |
◊ |
A |
x,y,z |
1_555 |
38 |
14 |
10098 |
192.7 |
2.1 |
0.341 |
4 |
0 |
0 |
0.000 |
Average: |
195.2 |
2.7 |
0.413 |
4 |
0 |
0 |
0.000 |
5 |
6 |
|
B |
21 |
11 |
10268 |
◊ |
A |
x,y,z-1 |
1_554 |
18 |
6 |
10098 |
189.8 |
-0.7 |
0.457 |
1 |
0 |
0 |
0.000 |
6 |
7 |
|
[BGC]A:304 |
11 |
1 |
291 |
◊ |
A |
x,y,z |
1_555 |
29 |
9 |
10098 |
169.0 |
2.2 |
0.321 |
1 |
0 |
0 |
0.000 |
8 |
|
[BGC]B:305 |
11 |
1 |
293 |
◊ |
B |
x,y,z |
1_555 |
28 |
8 |
10268 |
165.3 |
2.1 |
0.319 |
1 |
0 |
0 |
0.000 |
Average: |
167.2 |
2.2 |
0.320 |
1 |
0 |
0 |
0.000 |
7 |
9 |
|
[BGC]B:306 |
11 |
1 |
294 |
◊ |
B |
x,y,z |
1_555 |
20 |
5 |
10268 |
131.3 |
1.7 |
0.247 |
2 |
0 |
0 |
0.000 |
10 |
|
[BGC]A:305 |
9 |
1 |
289 |
◊ |
A |
x,y,z |
1_555 |
19 |
5 |
10098 |
119.4 |
1.8 |
0.293 |
1 |
0 |
0 |
0.000 |
Average: |
125.3 |
1.8 |
0.270 |
2 |
0 |
0 |
0.000 |
8 |
11 |
|
B |
16 |
4 |
10268 |
◊ |
A |
x,y-1,z-1 |
1_544 |
16 |
4 |
10098 |
129.1 |
-2.3 |
0.183 |
0 |
0 |
0 |
0.000 |
9 |
12 |
|
A |
16 |
5 |
10098 |
x |
A |
-x-1/2,y-1/2,-z |
4_445 |
18 |
7 |
10098 |
117.9 |
-0.7 |
0.431 |
0 |
0 |
0 |
0.000 |
10 |
13 |
|
[EDO]A:302 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
16 |
6 |
10098 |
94.4 |
2.7 |
0.276 |
6 |
0 |
0 |
0.000 |
11 |
14 |
|
[EDO]B:302 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
16 |
6 |
10268 |
92.9 |
2.7 |
0.281 |
6 |
0 |
0 |
0.000 |
12 |
15 |
|
B |
8 |
4 |
10268 |
◊ |
A |
x,y-1,z |
1_545 |
11 |
5 |
10098 |
84.5 |
0.5 |
0.570 |
2 |
0 |
0 |
0.000 |
13 |
16 |
|
[BGC]B:306 |
7 |
1 |
294 |
◊ |
A |
-x-1/2,y-1/2,-z |
4_445 |
14 |
4 |
10098 |
84.4 |
1.8 |
0.399 |
2 |
0 |
0 |
0.000 |
14 |
17 |
|
[EDO]B:303 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
10098 |
76.9 |
1.7 |
0.216 |
2 |
0 |
0 |
0.000 |
15 |
18 |
|
[EDO]B:303 |
4 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
14 |
6 |
10268 |
75.1 |
1.7 |
0.210 |
1 |
0 |
0 |
0.000 |
16 |
19 |
|
[BGC]A:306 |
7 |
1 |
292 |
cf |
[BGC]A:305 |
x,y,z |
1_555 |
5 |
1 |
289 |
61.8 |
1.0 |
0.135 |
0 |
0 |
0 |
0.000 |
20 |
|
[BGC]B:306 |
5 |
1 |
294 |
cf |
[BGC]B:305 |
x,y,z |
1_555 |
6 |
1 |
293 |
56.7 |
1.2 |
0.141 |
0 |
0 |
0 |
0.000 |
Average: |
59.3 |
1.1 |
0.138 |
0 |
0 |
0 |
0.000 |
17 |
21 |
|
[BGC]A:305 |
7 |
1 |
289 |
cf |
[BGC]A:304 |
x,y,z |
1_555 |
5 |
1 |
291 |
59.0 |
1.1 |
0.131 |
0 |
0 |
0 |
0.000 |
18 |
22 |
|
[BGC]B:305 |
6 |
1 |
293 |
cf |
[BGC]B:304 |
x,y,z |
1_555 |
5 |
1 |
304 |
49.7 |
1.3 |
0.161 |
0 |
0 |
0 |
0.000 |
23 |
|
[BGC]A:304 |
7 |
1 |
291 |
cf |
[BGC]A:303 |
x,y,z |
1_555 |
5 |
1 |
303 |
49.7 |
1.4 |
0.165 |
0 |
0 |
0 |
0.000 |
Average: |
49.7 |
1.3 |
0.163 |
0 |
0 |
0 |
0.000 |
19 |
24 |
|
[BGC]A:306 |
4 |
1 |
292 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
10098 |
39.5 |
0.8 |
0.424 |
1 |
0 |
0 |
0.000 |
20 |
25 |
|
B |
8 |
4 |
10268 |
f |
[BGC]A:306 |
x,y-1,z |
1_545 |
4 |
1 |
292 |
38.1 |
0.0 |
0.227 |
0 |
0 |
0 |
0.000 |
21 |
26 |
|
B |
6 |
2 |
10268 |
x |
B |
x,y,z-1 |
1_554 |
6 |
3 |
10268 |
35.4 |
-0.8 |
0.313 |
0 |
0 |
0 |
0.000 |
22 |
27 |
|
[CA]B:301 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
10268 |
34.4 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.094 |
28 |
|
[CA]A:301 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
10098 |
34.3 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.094 |
Average: |
34.3 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.094 |
23 |
29 |
|
[EDO]A:302 |
3 |
1 |
184 |
f |
[CA]A:301 |
x,y,z |
1_555 |
1 |
1 |
85 |
27.2 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.047 |
30 |
|
[EDO]B:302 |
2 |
1 |
184 |
f |
[CA]B:301 |
x,y,z |
1_555 |
1 |
1 |
85 |
26.9 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.047 |
Average: |
27.1 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.047 |
24 |
31 |
|
[BGC]B:305 |
1 |
1 |
293 |
◊ |
A |
-x-1/2,y-1/2,-z |
4_445 |
2 |
2 |
10098 |
10.0 |
0.2 |
0.363 |
0 |
0 |
0 |
0.000 |
25 |
32 |
|
B |
2 |
1 |
10268 |
◊ |
[EDO]A:302 |
x,y-1,z-1 |
1_544 |
2 |
1 |
184 |
8.3 |
0.4 |
0.874 |
0 |
0 |
0 |
0.000 |
26 |
33 |
|
B |
2 |
1 |
10268 |
◊ |
A |
-x-1/2,y-1/2,-z-1 |
4_444 |
1 |
1 |
10098 |
3.6 |
0.1 |
0.723 |
0 |
0 |
0 |
0.000 |
27 |
34 |
|
[EDO]B:302 |
2 |
1 |
184 |
◊ |
A |
x,y-1,z-1 |
1_544 |
1 |
1 |
10098 |
3.5 |
0.2 |
0.912 |
0 |
0 |
0 |
0.000 |
|