| ## |
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 |
177 |
48 |
15305 |
◊ |
A |
x,y,z |
1_555 |
174 |
49 |
15202 |
1647.3 |
-22.2 |
0.060 |
21 |
4 |
0 |
0.220 |
| 2 |
2 |
|
[NAD]B:377 |
42 |
1 |
862 |
f |
B |
x,y,z |
1_555 |
73 |
36 |
15305 |
595.7 |
-7.2 |
0.486 |
15 |
0 |
0 |
0.191 |
3 |
|
[NAD]A:377 |
44 |
1 |
859 |
f |
A |
x,y,z |
1_555 |
74 |
36 |
15202 |
591.9 |
-7.4 |
0.477 |
15 |
0 |
0 |
0.191 |
| Average: |
593.8 |
-7.3 |
0.482 |
15 |
0 |
0 |
0.191 |
| 3 |
4 |
|
A |
44 |
11 |
15202 |
◊ |
B |
x-1,y+1,z |
1_465 |
42 |
12 |
15305 |
371.3 |
3.1 |
0.902 |
7 |
6 |
0 |
0.000 |
| 4 |
5 |
|
B |
25 |
10 |
15305 |
◊ |
A |
x-1,y,z-1 |
1_454 |
28 |
12 |
15202 |
247.4 |
-1.4 |
0.504 |
2 |
2 |
0 |
0.000 |
| 5 |
6 |
|
A |
14 |
5 |
15202 |
x |
A |
x,y-1,z |
1_545 |
17 |
4 |
15202 |
148.5 |
-2.1 |
0.314 |
1 |
0 |
0 |
0.000 |
| 6 |
7 |
|
[PYZ]B:378 |
6 |
1 |
243 |
f |
B |
x,y,z |
1_555 |
23 |
12 |
15305 |
129.3 |
0.5 |
0.198 |
1 |
0 |
0 |
0.001 |
8 |
|
[PYZ]A:378 |
6 |
1 |
246 |
f |
A |
x,y,z |
1_555 |
24 |
13 |
15202 |
123.2 |
0.6 |
0.210 |
2 |
0 |
0 |
0.001 |
| Average: |
126.2 |
0.6 |
0.204 |
2 |
0 |
0 |
0.001 |
| 7 |
9 |
|
B |
8 |
3 |
15305 |
x |
B |
x,y-1,z |
1_545 |
10 |
5 |
15305 |
75.8 |
-1.4 |
0.317 |
0 |
0 |
0 |
0.000 |
| 8 |
10 |
|
[CL]B:601 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
9 |
3 |
15305 |
59.5 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.050 |
| 9 |
11 |
|
[PYZ]A:378 |
5 |
1 |
246 |
cf |
[NAD]A:377 |
x,y,z |
1_555 |
8 |
1 |
859 |
52.1 |
0.3 |
0.239 |
0 |
0 |
0 |
0.000 |
12 |
|
[PYZ]B:378 |
3 |
1 |
243 |
f |
[NAD]B:377 |
x,y,z |
1_555 |
9 |
1 |
862 |
48.2 |
0.3 |
0.426 |
0 |
0 |
0 |
0.000 |
| Average: |
50.1 |
0.3 |
0.333 |
0 |
0 |
0 |
0.000 |
| 10 |
13 |
|
[CL]B:601 |
1 |
1 |
125 |
◊ |
A |
x-1,y,z-1 |
1_454 |
4 |
2 |
15202 |
31.1 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.000 |
| 11 |
14 |
|
[ZN]B:376 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
5 |
5 |
15305 |
29.8 |
-22.5 |
0.000 |
0 |
0 |
0 |
0.308 |
15 |
|
[ZN]A:376 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
5 |
5 |
15202 |
29.3 |
-22.4 |
0.000 |
0 |
0 |
0 |
0.308 |
| Average: |
29.6 |
-22.5 |
0.000 |
0 |
0 |
0 |
0.308 |
| 12 |
16 |
|
[NAD]B:377 |
2 |
1 |
862 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
15202 |
23.7 |
-0.1 |
0.433 |
0 |
0 |
0 |
0.000 |
17 |
|
[NAD]A:377 |
2 |
1 |
859 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
15305 |
21.7 |
-0.1 |
0.435 |
0 |
0 |
0 |
0.000 |
| Average: |
22.7 |
-0.1 |
0.434 |
0 |
0 |
0 |
0.001 |
| 13 |
18 |
|
[PYZ]B:378 |
3 |
1 |
243 |
f |
[ZN]B:376 |
x,y,z |
1_555 |
1 |
1 |
98 |
22.5 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.126 |
19 |
|
[PYZ]A:378 |
3 |
1 |
246 |
f |
[ZN]A:376 |
x,y,z |
1_555 |
1 |
1 |
98 |
22.4 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.126 |
| Average: |
22.5 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.126 |
| 14 |
20 |
|
[NAD]A:377 |
3 |
1 |
859 |
f |
[ZN]A:376 |
x,y,z |
1_555 |
1 |
1 |
98 |
21.5 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.106 |
21 |
|
[NAD]B:377 |
3 |
1 |
862 |
f |
[ZN]B:376 |
x,y,z |
1_555 |
1 |
1 |
98 |
21.4 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.106 |
| Average: |
21.5 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.106 |
| 15 |
22 |
|
B |
3 |
2 |
15305 |
◊ |
A |
x,y,z-1 |
1_554 |
5 |
4 |
15202 |
19.2 |
0.4 |
0.755 |
0 |
0 |
0 |
0.000 |
| 16 |
23 |
|
[PYZ]A:378 |
1 |
1 |
246 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
15305 |
0.6 |
-0.0 |
0.739 |
0 |
0 |
0 |
0.000 |
| 17 |
24 |
|
[PYZ]B:378 |
1 |
1 |
243 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
15202 |
0.4 |
-0.0 |
0.761 |
0 |
0 |
0 |
0.000 |
|