## |
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 |
108 |
31 |
20836 |
◊ |
A |
x,y,z |
1_555 |
100 |
23 |
21033 |
934.4 |
-5.9 |
0.582 |
10 |
4 |
0 |
0.000 |
2 |
2 |
|
B |
63 |
17 |
20836 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
77 |
26 |
21033 |
680.1 |
-6.9 |
0.331 |
8 |
3 |
0 |
0.000 |
3 |
3 |
|
B |
66 |
18 |
20836 |
◊ |
A |
-x-1,y-1/2,-z+1/2 |
3_445 |
66 |
16 |
21033 |
645.1 |
0.2 |
0.838 |
11 |
9 |
0 |
0.000 |
4 |
4 |
|
B |
67 |
21 |
20836 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
64 |
20 |
21033 |
612.5 |
-2.3 |
0.693 |
6 |
0 |
0 |
0.000 |
5 |
5 |
|
[S2I]A:2267 |
28 |
1 |
613 |
f |
A |
x,y,z |
1_555 |
59 |
22 |
21033 |
401.4 |
-5.0 |
0.647 |
2 |
0 |
0 |
0.044 |
6 |
|
[S2I]B:2267 |
28 |
1 |
612 |
f |
B |
x,y,z |
1_555 |
58 |
22 |
20836 |
400.4 |
-5.0 |
0.657 |
1 |
0 |
0 |
0.044 |
Average: |
400.9 |
-5.0 |
0.652 |
2 |
0 |
0 |
0.044 |
6 |
7 |
|
A |
15 |
6 |
21033 |
x |
A |
-x,y-1/2,-z+1/2 |
3_545 |
16 |
6 |
21033 |
122.8 |
-1.7 |
0.383 |
1 |
0 |
0 |
0.000 |
7 |
8 |
|
[EDO]A:2272 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
16 |
9 |
21033 |
110.7 |
2.3 |
0.391 |
2 |
0 |
0 |
0.000 |
8 |
9 |
|
[EDO]A:2275 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
21033 |
110.2 |
3.1 |
0.423 |
3 |
0 |
0 |
0.000 |
9 |
10 |
|
[EDO]A:2268 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
22 |
9 |
21033 |
109.1 |
3.9 |
0.691 |
5 |
0 |
0 |
0.000 |
10 |
11 |
|
[EDO]B:2269 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
21 |
8 |
20836 |
108.2 |
2.8 |
0.468 |
3 |
0 |
0 |
0.000 |
11 |
12 |
|
[EDO]A:2269 |
4 |
1 |
182 |
◊ |
A |
x,y,z |
1_555 |
21 |
10 |
21033 |
106.6 |
3.1 |
0.452 |
1 |
0 |
0 |
0.000 |
12 |
13 |
|
[EDO]A:2270 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
20 |
5 |
21033 |
105.9 |
2.0 |
0.379 |
0 |
0 |
0 |
0.000 |
13 |
14 |
|
[EDO]A:2276 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
17 |
7 |
21033 |
102.7 |
2.2 |
0.423 |
3 |
0 |
0 |
0.000 |
14 |
15 |
|
[EDO]A:2273 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
11 |
8 |
21033 |
97.2 |
2.7 |
0.476 |
3 |
0 |
0 |
0.000 |
15 |
16 |
|
[EDO]B:2268 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
12 |
6 |
20836 |
85.0 |
1.7 |
0.235 |
0 |
0 |
0 |
0.000 |
16 |
17 |
|
[EDO]A:2274 |
4 |
1 |
187 |
◊ |
A |
x,y,z |
1_555 |
14 |
6 |
21033 |
82.4 |
2.4 |
0.470 |
1 |
0 |
0 |
0.000 |
17 |
18 |
|
[EDO]A:2271 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
16 |
5 |
21033 |
79.6 |
2.2 |
0.299 |
1 |
0 |
0 |
0.000 |
18 |
19 |
|
B |
8 |
3 |
20836 |
f |
[EDO]A:2271 |
-x-1,y-1/2,-z+1/2 |
3_445 |
3 |
1 |
185 |
58.6 |
1.7 |
0.309 |
1 |
0 |
0 |
0.000 |
19 |
20 |
|
B |
6 |
3 |
20836 |
f |
[EDO]A:2274 |
-x-1,y-1/2,-z+1/2 |
3_445 |
4 |
1 |
187 |
57.8 |
1.4 |
0.794 |
1 |
0 |
0 |
0.000 |
20 |
21 |
|
[FE2]B:1 |
1 |
1 |
137 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
20836 |
57.3 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.055 |
22 |
|
[FE2]A:1 |
1 |
1 |
137 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
21033 |
56.9 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.055 |
Average: |
57.1 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.055 |
21 |
23 |
|
[S2I]A:2267 |
6 |
1 |
613 |
f |
[FE2]A:1 |
x,y,z |
1_555 |
1 |
1 |
137 |
52.0 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.045 |
24 |
|
[S2I]B:2267 |
7 |
1 |
612 |
f |
[FE2]B:1 |
x,y,z |
1_555 |
1 |
1 |
137 |
51.4 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.045 |
Average: |
51.7 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.045 |
22 |
25 |
|
[EDO]B:2268 |
4 |
1 |
184 |
f |
A |
-x-1,y-1/2,-z+1/2 |
3_445 |
5 |
3 |
21033 |
46.8 |
0.2 |
0.435 |
0 |
0 |
0 |
0.000 |
23 |
26 |
|
[EDO]A:2270 |
3 |
1 |
184 |
f |
[EDO]A:2269 |
x,y,z |
1_555 |
2 |
1 |
182 |
32.7 |
1.4 |
1.000 |
1 |
0 |
0 |
0.000 |
24 |
27 |
|
[EDO]A:2274 |
2 |
1 |
187 |
f |
[EDO]A:2273 |
x,y,z |
1_555 |
2 |
1 |
186 |
14.8 |
0.7 |
1.000 |
0 |
0 |
0 |
0.000 |
25 |
28 |
|
[EDO]B:2268 |
2 |
1 |
184 |
◊ |
[EDO]A:2270 |
-x-1,y-1/2,-z+1/2 |
3_445 |
1 |
1 |
184 |
8.7 |
0.4 |
1.000 |
0 |
0 |
0 |
0.000 |
|