| ## |
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 |
147 |
36 |
10800 |
◊ |
A |
x,y,z |
1_555 |
144 |
35 |
10852 |
1439.5 |
-15.3 |
0.126 |
14 |
17 |
0 |
0.257 |
| 2 |
2 |
|
B |
94 |
25 |
10800 |
◊ |
B |
-x+1,y,-z+1/2 |
3_655 |
94 |
25 |
10800 |
840.5 |
-8.7 |
0.236 |
7 |
4 |
0 |
0.162 |
3 |
|
A |
88 |
25 |
10852 |
◊ |
A |
-x+1,y,-z+1/2 |
3_655 |
89 |
25 |
10852 |
815.8 |
-9.4 |
0.192 |
7 |
4 |
0 |
0.162 |
| Average: |
828.2 |
-9.1 |
0.214 |
7 |
4 |
0 |
0.162 |
| 3 |
4 |
|
B |
42 |
12 |
10800 |
◊ |
A |
-x+1,y,-z+1/2 |
3_655 |
45 |
12 |
10852 |
387.8 |
-3.0 |
0.417 |
5 |
4 |
0 |
0.052 |
| 4 |
5 |
|
A |
40 |
12 |
10852 |
◊ |
B |
x-1/2,-y+1/2,-z+1 |
8_456 |
37 |
9 |
10800 |
341.3 |
-1.0 |
0.606 |
4 |
0 |
0 |
0.000 |
| 5 |
6 |
|
[XMP]A:300 |
23 |
1 |
480 |
f |
A |
x,y,z |
1_555 |
43 |
16 |
10852 |
295.4 |
-4.3 |
0.557 |
10 |
0 |
0 |
0.216 |
7 |
|
[XMP]B:300 |
23 |
1 |
478 |
f |
B |
x,y,z |
1_555 |
43 |
15 |
10800 |
294.7 |
-4.3 |
0.522 |
13 |
0 |
0 |
0.216 |
| Average: |
295.1 |
-4.3 |
0.540 |
12 |
0 |
0 |
0.216 |
| 6 |
8 |
|
A |
27 |
9 |
10852 |
◊ |
B |
x-1,y,z |
1_455 |
28 |
10 |
10800 |
235.7 |
0.7 |
0.687 |
5 |
5 |
0 |
0.000 |
| 7 |
9 |
|
B |
21 |
8 |
10800 |
◊ |
A |
x-1/2,y+1/2,z |
5_455 |
27 |
12 |
10852 |
190.5 |
1.4 |
0.795 |
2 |
2 |
0 |
0.000 |
| 8 |
10 |
|
[POP]A:301 |
9 |
1 |
260 |
f |
A |
x,y,z |
1_555 |
30 |
14 |
10852 |
126.4 |
-1.4 |
0.497 |
7 |
0 |
0 |
0.112 |
11 |
|
[POP]B:301 |
9 |
1 |
263 |
f |
B |
x,y,z |
1_555 |
28 |
13 |
10800 |
123.9 |
-1.8 |
0.463 |
7 |
0 |
0 |
0.112 |
| Average: |
125.2 |
-1.6 |
0.480 |
7 |
0 |
0 |
0.112 |
| 9 |
12 |
|
A |
10 |
4 |
10852 |
◊ |
A |
-x,y,-z+1/2 |
3_555 |
10 |
4 |
10852 |
59.8 |
-0.1 |
0.617 |
0 |
0 |
0 |
0.000 |
| 10 |
13 |
|
A |
4 |
2 |
10852 |
x |
A |
x-1,y,z |
1_455 |
8 |
3 |
10852 |
57.6 |
-1.2 |
0.091 |
0 |
0 |
0 |
0.000 |
| 11 |
14 |
|
[POP]A:301 |
4 |
1 |
260 |
f |
[XMP]A:300 |
x,y,z |
1_555 |
5 |
1 |
480 |
42.7 |
-0.2 |
0.585 |
0 |
0 |
0 |
0.005 |
15 |
|
[POP]B:301 |
5 |
1 |
263 |
f |
[XMP]B:300 |
x,y,z |
1_555 |
5 |
1 |
478 |
41.5 |
-0.1 |
0.594 |
0 |
0 |
0 |
0.005 |
| Average: |
42.1 |
-0.1 |
0.589 |
0 |
0 |
0 |
0.005 |
| 12 |
16 |
|
[MG]B:302 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
15 |
8 |
10800 |
37.3 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.089 |
17 |
|
[MG]A:302 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
14 |
8 |
10852 |
35.3 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.089 |
| Average: |
36.3 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.089 |
| 13 |
18 |
|
[MG]B:303 |
1 |
1 |
98 |
f |
[POP]B:301 |
x,y,z |
1_555 |
5 |
1 |
263 |
35.0 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.115 |
19 |
|
[MG]A:303 |
1 |
1 |
98 |
f |
[POP]A:301 |
x,y,z |
1_555 |
3 |
1 |
260 |
33.1 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.115 |
| Average: |
34.1 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.115 |
| 14 |
20 |
|
[MG]B:302 |
1 |
1 |
98 |
f |
[POP]B:301 |
x,y,z |
1_555 |
4 |
1 |
263 |
32.1 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.092 |
21 |
|
[MG]A:302 |
1 |
1 |
98 |
f |
[POP]A:301 |
x,y,z |
1_555 |
5 |
1 |
260 |
31.4 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.092 |
| Average: |
31.8 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.092 |
| 15 |
22 |
|
[MG]A:303 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
10852 |
31.8 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.083 |
23 |
|
[MG]B:303 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
6 |
10800 |
31.1 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.083 |
| Average: |
31.4 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.083 |
| 16 |
24 |
|
B |
2 |
1 |
10800 |
x |
B |
x-1/2,-y+1/2,-z+1 |
8_456 |
1 |
1 |
10800 |
27.5 |
0.7 |
0.389 |
0 |
0 |
0 |
0.000 |
| 17 |
25 |
|
[MG]A:302 |
1 |
1 |
98 |
f |
[XMP]A:300 |
x,y,z |
1_555 |
4 |
1 |
480 |
21.4 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.071 |
26 |
|
[MG]B:302 |
1 |
1 |
98 |
f |
[XMP]B:300 |
x,y,z |
1_555 |
3 |
1 |
478 |
18.3 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.071 |
| Average: |
19.9 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.071 |
| 18 |
27 |
|
[MG]B:303 |
1 |
1 |
98 |
f |
[XMP]B:300 |
x,y,z |
1_555 |
4 |
1 |
478 |
16.7 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.032 |
28 |
|
[MG]A:303 |
1 |
1 |
98 |
f |
[XMP]A:300 |
x,y,z |
1_555 |
5 |
1 |
480 |
15.8 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.032 |
| Average: |
16.3 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.032 |
| 19 |
29 |
|
A |
3 |
1 |
10852 |
◊ |
B |
x-1/2,y-1/2,z |
5_445 |
2 |
1 |
10800 |
10.1 |
0.1 |
0.687 |
0 |
0 |
0 |
0.000 |
| 20 |
30 |
|
[MG]A:303 |
1 |
1 |
98 |
f |
[MG]A:302 |
x,y,z |
1_555 |
1 |
1 |
98 |
4.9 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.024 |
| 21 |
31 |
|
[MG]B:303 |
1 |
1 |
98 |
f |
[MG]B:302 |
x,y,z |
1_555 |
1 |
1 |
98 |
4.6 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.010 |
|