| ## |
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 |
227 |
65 |
16597 |
◊ |
A |
x,y,z |
1_555 |
218 |
68 |
17023 |
2187.4 |
-32.4 |
0.298 |
21 |
6 |
0 |
0.749 |
2 |
|
B |
211 |
59 |
16597 |
◊ |
A |
-x+1,-y-1,z |
2_645 |
220 |
64 |
17023 |
2094.7 |
-26.1 |
0.494 |
17 |
7 |
0 |
0.749 |
| Average: |
2141.1 |
-29.2 |
0.396 |
19 |
7 |
0 |
0.749 |
| 2 |
3 |
|
[SPM]A:1303 |
12 |
1 |
451 |
◊ |
B |
-x+1,-y-1,z |
2_645 |
27 |
7 |
16597 |
169.2 |
2.8 |
0.397 |
0 |
0 |
0 |
0.000 |
| 3 |
4 |
|
[SPM]A:1303 |
13 |
1 |
451 |
f |
A |
x,y,z |
1_555 |
23 |
7 |
17023 |
165.6 |
3.3 |
0.409 |
0 |
0 |
0 |
0.000 |
| 4 |
5 |
|
A |
14 |
6 |
17023 |
◊ |
B |
x,y,z-1 |
1_554 |
14 |
5 |
16597 |
142.7 |
-1.7 |
0.515 |
0 |
2 |
0 |
0.000 |
6 |
|
B |
16 |
4 |
16597 |
◊ |
A |
-x+1,-y-1,z-1 |
2_644 |
11 |
3 |
17023 |
104.7 |
-1.8 |
0.461 |
0 |
2 |
0 |
0.000 |
| Average: |
123.7 |
-1.8 |
0.488 |
0 |
2 |
0 |
0.000 |
| 5 |
7 |
|
[CL]A:1302 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
17023 |
66.4 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.076 |
| 6 |
8 |
|
[CL]A:1304 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
17023 |
65.1 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.086 |
| 7 |
9 |
|
[K]A:1301 |
1 |
1 |
216 |
x |
A |
x,y,z |
1_555 |
7 |
4 |
17023 |
61.6 |
-38.4 |
0.000 |
0 |
0 |
0 |
0.257 |
10 |
|
[K]A:1301 |
1 |
1 |
216 |
x |
B |
x,y,z |
1_555 |
7 |
4 |
16597 |
61.4 |
-38.2 |
0.000 |
0 |
0 |
0 |
0.257 |
| Average: |
61.5 |
-38.3 |
0.000 |
0 |
0 |
0 |
0.257 |
| 8 |
11 |
|
[K]A:1300 |
1 |
1 |
216 |
x |
B |
x,y,z |
1_555 |
11 |
4 |
16597 |
59.0 |
-38.1 |
0.000 |
0 |
0 |
0 |
0.253 |
12 |
|
[K]A:1300 |
1 |
1 |
216 |
x |
A |
x,y,z |
1_555 |
11 |
4 |
17023 |
57.3 |
-37.1 |
0.000 |
0 |
0 |
0 |
0.253 |
| Average: |
58.1 |
-37.6 |
0.000 |
0 |
0 |
0 |
0.253 |
| 9 |
13 |
|
[K]A:1301 |
1 |
1 |
216 |
f |
[K]A:1300 |
x,y,z |
1_555 |
1 |
1 |
216 |
57.4 |
-57.4 |
0.000 |
0 |
0 |
0 |
0.096 |
| 10 |
14 |
|
[CL]A:1306 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
17023 |
57.3 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.074 |
| 11 |
15 |
|
A |
7 |
3 |
17023 |
x |
A |
x,y,z-1 |
1_554 |
4 |
2 |
17023 |
52.7 |
0.3 |
0.736 |
0 |
0 |
0 |
0.000 |
16 |
|
B |
5 |
3 |
16597 |
x |
B |
x,y,z-1 |
1_554 |
4 |
2 |
16597 |
39.9 |
0.3 |
0.784 |
0 |
0 |
0 |
0.000 |
| Average: |
46.3 |
0.3 |
0.760 |
0 |
0 |
0 |
0.000 |
| 12 |
17 |
|
[CL]A:1302 |
1 |
1 |
125 |
◊ |
B |
-x+1,-y-1,z |
2_645 |
10 |
4 |
16597 |
40.3 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.045 |
| 13 |
18 |
|
A |
6 |
5 |
17023 |
◊ |
A |
-x+1,-y-1,z |
2_645 |
6 |
5 |
17023 |
39.2 |
0.2 |
0.818 |
0 |
0 |
0 |
0.000 |
19 |
|
B |
7 |
6 |
16597 |
◊ |
B |
-x+1,-y-1,z |
2_645 |
7 |
6 |
16597 |
34.6 |
0.2 |
0.814 |
0 |
0 |
0 |
0.000 |
| Average: |
36.9 |
0.2 |
0.816 |
0 |
0 |
0 |
0.000 |
| 14 |
20 |
|
[SPM]A:1303 |
5 |
1 |
451 |
f |
[CL]A:1304 |
x,y,z |
1_555 |
1 |
1 |
125 |
32.8 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.025 |
| 15 |
21 |
|
[CA]A:1305 |
1 |
1 |
85 |
x |
B |
x,y,z |
1_555 |
3 |
1 |
16597 |
26.7 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.035 |
22 |
|
[CA]A:1305 |
1 |
1 |
85 |
x |
A |
x,y,z |
1_555 |
3 |
1 |
17023 |
26.1 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.035 |
| Average: |
26.4 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.035 |
| 16 |
23 |
|
[CA]A:1305 |
1 |
1 |
85 |
f |
[K]A:1300 |
x,y,z |
1_555 |
1 |
1 |
216 |
12.4 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.013 |
| 17 |
24 |
|
[CL]A:1306 |
1 |
1 |
125 |
◊ |
B |
-x+1,-y-1,z |
2_645 |
1 |
1 |
16597 |
5.5 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.006 |
|