| ## |
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 |
|
C |
78 |
21 |
6497 |
◊ |
C |
-x+1,y,-z |
2_655 |
78 |
21 |
6497 |
797.2 |
5.3 |
0.964 |
9 |
10 |
0 |
0.000 |
2 |
|
B |
72 |
21 |
6531 |
◊ |
A |
x,y,z |
1_555 |
76 |
22 |
6499 |
792.9 |
5.4 |
0.964 |
14 |
9 |
0 |
0.000 |
3 |
|
D |
77 |
22 |
6529 |
◊ |
D |
-x+1,y,-z |
2_655 |
77 |
22 |
6529 |
788.9 |
5.9 |
0.969 |
6 |
10 |
0 |
0.000 |
| Average: |
793.0 |
5.5 |
0.966 |
10 |
10 |
0 |
0.000 |
| 2 |
4 |
|
C |
75 |
21 |
6497 |
◊ |
B |
x,y,z |
1_555 |
80 |
25 |
6531 |
666.8 |
-9.9 |
0.203 |
4 |
0 |
0 |
1.000 |
5 |
|
D |
77 |
25 |
6529 |
◊ |
B |
-x+1,y,-z |
2_655 |
75 |
21 |
6531 |
664.2 |
-9.8 |
0.187 |
2 |
0 |
0 |
1.000 |
6 |
|
D |
75 |
21 |
6529 |
◊ |
A |
x,y,z |
1_555 |
79 |
24 |
6499 |
656.8 |
-9.6 |
0.207 |
4 |
0 |
0 |
1.000 |
7 |
|
C |
75 |
25 |
6497 |
◊ |
A |
-x+1,y,-z |
2_655 |
74 |
21 |
6499 |
654.9 |
-9.7 |
0.195 |
1 |
0 |
0 |
1.000 |
| Average: |
660.7 |
-9.7 |
0.198 |
3 |
0 |
0 |
1.000 |
| 3 |
8 |
|
D |
31 |
10 |
6529 |
◊ |
C |
-x+1,y-1,-z |
2_645 |
35 |
10 |
6497 |
284.9 |
-0.8 |
0.675 |
0 |
0 |
0 |
0.000 |
9 |
|
B |
30 |
10 |
6531 |
◊ |
A |
-x,y,-z |
2_555 |
33 |
10 |
6499 |
275.0 |
-1.4 |
0.608 |
0 |
0 |
0 |
0.000 |
| Average: |
279.9 |
-1.1 |
0.641 |
0 |
0 |
0 |
0.000 |
| 4 |
10 |
|
C |
16 |
7 |
6497 |
◊ |
A |
x,y,z |
1_555 |
14 |
7 |
6499 |
158.6 |
2.3 |
0.903 |
3 |
0 |
0 |
0.000 |
11 |
|
D |
14 |
7 |
6529 |
◊ |
B |
x,y,z |
1_555 |
15 |
7 |
6531 |
152.0 |
2.2 |
0.898 |
2 |
0 |
0 |
0.000 |
| Average: |
155.3 |
2.2 |
0.900 |
3 |
0 |
0 |
0.000 |
| 5 |
12 |
|
A |
12 |
7 |
6499 |
◊ |
C |
-x+1/2,-y+1,z-1/2 |
3_564 |
14 |
7 |
6497 |
109.5 |
-1.5 |
0.419 |
0 |
0 |
0 |
0.000 |
| 6 |
13 |
|
[21H]D:201 |
5 |
1 |
202 |
◊ |
D |
x,y,z |
1_555 |
14 |
9 |
6529 |
102.4 |
2.6 |
0.463 |
1 |
0 |
0 |
0.000 |
| 7 |
14 |
|
[21H]C:201 |
5 |
1 |
204 |
◊ |
C |
x,y,z |
1_555 |
16 |
11 |
6497 |
102.0 |
2.2 |
0.313 |
1 |
0 |
0 |
0.000 |
| 8 |
15 |
|
[21H]A:201 |
5 |
1 |
203 |
◊ |
A |
x,y,z |
1_555 |
12 |
9 |
6499 |
99.3 |
2.4 |
0.286 |
0 |
0 |
0 |
0.000 |
| 9 |
16 |
|
A |
6 |
2 |
6499 |
◊ |
A |
-x,y,-z |
2_555 |
6 |
2 |
6499 |
84.0 |
0.3 |
0.727 |
1 |
2 |
0 |
0.000 |
17 |
|
D |
6 |
2 |
6529 |
◊ |
C |
x,y-1,z |
1_545 |
6 |
2 |
6497 |
81.4 |
0.3 |
0.737 |
1 |
2 |
0 |
0.000 |
18 |
|
B |
6 |
2 |
6531 |
◊ |
B |
-x,y,-z |
2_555 |
6 |
2 |
6531 |
81.1 |
0.9 |
0.833 |
1 |
2 |
0 |
0.000 |
| Average: |
82.2 |
0.5 |
0.766 |
1 |
2 |
0 |
0.000 |
| 10 |
19 |
|
A |
14 |
7 |
6499 |
◊ |
B |
-x+1/2,-y+1,z-1/2 |
3_564 |
10 |
7 |
6531 |
81.7 |
0.4 |
0.711 |
0 |
0 |
0 |
0.000 |
| 11 |
20 |
|
[FMT]B:201 |
3 |
1 |
149 |
◊ |
B |
x,y,z |
1_555 |
14 |
9 |
6531 |
79.2 |
-0.0 |
0.625 |
0 |
0 |
0 |
0.000 |
| 12 |
21 |
|
D |
7 |
2 |
6529 |
◊ |
B |
-x+1/2,-y+1,z-1/2 |
3_564 |
9 |
3 |
6531 |
73.2 |
-0.3 |
0.589 |
0 |
0 |
0 |
0.000 |
| 13 |
22 |
|
[21H]C:201 |
4 |
1 |
204 |
f |
A |
-x+1,y,-z |
2_655 |
6 |
4 |
6499 |
64.1 |
1.1 |
0.157 |
0 |
0 |
0 |
0.000 |
| 14 |
23 |
|
[21H]A:201 |
5 |
1 |
203 |
f |
D |
x,y,z |
1_555 |
6 |
4 |
6529 |
62.4 |
0.4 |
0.007 |
0 |
0 |
0 |
0.000 |
| 15 |
24 |
|
[21H]D:201 |
4 |
1 |
202 |
f |
B |
-x+1,y,-z |
2_655 |
6 |
4 |
6531 |
57.9 |
0.5 |
0.147 |
0 |
0 |
0 |
0.000 |
| 16 |
25 |
|
[FMT]B:201 |
3 |
1 |
149 |
f |
C |
x,y,z |
1_555 |
5 |
3 |
6497 |
34.3 |
-1.1 |
0.278 |
0 |
0 |
0 |
0.100 |
| 17 |
26 |
|
D |
2 |
2 |
6529 |
◊ |
C |
-x+1,y,-z |
2_655 |
2 |
2 |
6497 |
21.6 |
-0.7 |
0.220 |
0 |
0 |
0 |
0.035 |
27 |
|
B |
2 |
2 |
6531 |
◊ |
A |
-x+1,y,-z |
2_655 |
2 |
2 |
6499 |
19.5 |
-0.6 |
0.244 |
0 |
0 |
0 |
0.035 |
| Average: |
20.6 |
-0.7 |
0.232 |
0 |
0 |
0 |
0.035 |
| 18 |
28 |
|
A |
3 |
2 |
6499 |
x |
A |
x-1/2,-y+1,-z-1/2 |
4_464 |
3 |
2 |
6499 |
17.9 |
0.1 |
0.584 |
0 |
0 |
0 |
0.000 |
|