| ## |
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 |
|
H |
197 |
53 |
12417 |
◊ |
L |
x,y,z |
1_555 |
231 |
61 |
11348 |
1875.1 |
-26.7 |
0.105 |
10 |
4 |
0 |
1.000 |
2 |
|
B |
193 |
53 |
12323 |
◊ |
A |
x,y,z |
1_555 |
229 |
60 |
11355 |
1860.1 |
-26.0 |
0.109 |
9 |
4 |
0 |
1.000 |
| Average: |
1867.6 |
-26.4 |
0.107 |
10 |
4 |
0 |
1.000 |
| 2 |
3 |
|
L |
84 |
23 |
11348 |
◊ |
A |
x,y,z |
1_555 |
84 |
23 |
11355 |
775.3 |
-7.7 |
0.358 |
3 |
0 |
0 |
0.132 |
| 3 |
4 |
|
H |
53 |
17 |
12417 |
◊ |
H |
y,x,-z |
7_555 |
53 |
17 |
12417 |
481.9 |
7.2 |
0.987 |
6 |
2 |
0 |
0.000 |
| 4 |
5 |
|
L |
50 |
18 |
11348 |
◊ |
A |
-y-1/2,x+1/2,z-1/4 |
3_454 |
52 |
18 |
11355 |
478.8 |
0.8 |
0.846 |
16 |
4 |
0 |
0.000 |
| 5 |
6 |
|
H |
46 |
15 |
12417 |
◊ |
L |
y,x,-z |
7_555 |
49 |
14 |
11348 |
428.2 |
-4.0 |
0.454 |
2 |
0 |
0 |
0.000 |
| 6 |
7 |
|
B |
35 |
13 |
12323 |
◊ |
A |
-y,-x,-z+1/2 |
8_555 |
34 |
12 |
11355 |
316.5 |
-0.3 |
0.743 |
2 |
0 |
0 |
0.000 |
| 7 |
8 |
|
[OHM]B:1002 |
19 |
1 |
581 |
◊ |
B |
x,y,z |
1_555 |
51 |
13 |
12323 |
272.9 |
2.3 |
0.419 |
5 |
0 |
0 |
0.003 |
9 |
|
[OHM]H:1001 |
19 |
1 |
578 |
◊ |
H |
x,y,z |
1_555 |
48 |
13 |
12417 |
266.4 |
2.0 |
0.409 |
5 |
0 |
0 |
0.003 |
| Average: |
269.7 |
2.1 |
0.414 |
5 |
0 |
0 |
0.003 |
| 8 |
10 |
|
H |
23 |
5 |
12417 |
◊ |
L |
-y-1/2,x+1/2,z-1/4 |
3_454 |
22 |
7 |
11348 |
206.8 |
-2.9 |
0.333 |
1 |
0 |
0 |
0.000 |
11 |
|
A |
21 |
7 |
11355 |
◊ |
B |
-y-1/2,x+1/2,z-1/4 |
3_454 |
23 |
5 |
12323 |
186.6 |
-2.6 |
0.377 |
1 |
0 |
0 |
0.000 |
| Average: |
196.7 |
-2.7 |
0.355 |
1 |
0 |
0 |
0.000 |
| 9 |
12 |
|
[OHM]H:1001 |
15 |
1 |
578 |
◊ |
L |
x,y,z |
1_555 |
26 |
8 |
11348 |
153.6 |
2.2 |
0.454 |
1 |
0 |
0 |
0.000 |
13 |
|
[OHM]B:1002 |
15 |
1 |
581 |
◊ |
A |
x,y,z |
1_555 |
22 |
7 |
11355 |
146.1 |
0.4 |
0.269 |
1 |
0 |
0 |
0.000 |
| Average: |
149.8 |
1.3 |
0.361 |
1 |
0 |
0 |
0.000 |
| 10 |
14 |
|
H |
28 |
8 |
12417 |
◊ |
A |
x,y,z |
1_555 |
14 |
6 |
11355 |
150.5 |
2.0 |
0.859 |
3 |
0 |
0 |
0.000 |
15 |
|
B |
20 |
6 |
12323 |
◊ |
L |
x,y,z |
1_555 |
11 |
5 |
11348 |
130.7 |
1.8 |
0.850 |
4 |
0 |
0 |
0.000 |
| Average: |
140.6 |
1.9 |
0.854 |
4 |
0 |
0 |
0.000 |
| 11 |
16 |
|
B |
20 |
10 |
12323 |
◊ |
B |
-y,-x,-z+1/2 |
8_555 |
20 |
10 |
12323 |
149.9 |
0.2 |
0.755 |
4 |
0 |
0 |
0.000 |
| 12 |
17 |
|
H |
14 |
7 |
12417 |
◊ |
B |
x,y,z |
1_555 |
15 |
7 |
12323 |
123.5 |
1.7 |
0.884 |
2 |
0 |
0 |
0.000 |
| 13 |
18 |
|
[OHM]H:1001 |
5 |
1 |
578 |
f |
A |
x,y,z |
1_555 |
12 |
3 |
11355 |
63.3 |
-0.6 |
0.299 |
0 |
0 |
0 |
0.100 |
19 |
|
[OHM]B:1002 |
5 |
1 |
581 |
f |
L |
x,y,z |
1_555 |
11 |
3 |
11348 |
56.5 |
0.9 |
0.514 |
0 |
0 |
0 |
0.100 |
| Average: |
59.9 |
0.1 |
0.406 |
0 |
0 |
0 |
0.100 |
| 14 |
20 |
|
H |
9 |
1 |
12417 |
◊ |
A |
-y-1/2,x+1/2,z-1/4 |
3_454 |
4 |
1 |
11355 |
56.3 |
0.7 |
0.657 |
0 |
0 |
0 |
0.000 |
21 |
|
L |
4 |
1 |
11348 |
◊ |
B |
-y-1/2,x+1/2,z-1/4 |
3_454 |
9 |
1 |
12323 |
52.8 |
0.6 |
0.659 |
0 |
0 |
0 |
0.000 |
| Average: |
54.6 |
0.7 |
0.658 |
0 |
0 |
0 |
0.000 |
| 15 |
22 |
|
H |
2 |
2 |
12417 |
x |
H |
-y-1/2,x+1/2,z-1/4 |
3_454 |
2 |
1 |
12417 |
29.1 |
0.1 |
0.404 |
0 |
0 |
0 |
0.000 |
23 |
|
B |
3 |
1 |
12323 |
x |
B |
-y-1/2,x+1/2,z-1/4 |
3_454 |
2 |
2 |
12323 |
19.3 |
0.0 |
0.474 |
0 |
0 |
0 |
0.000 |
| Average: |
24.2 |
0.1 |
0.439 |
0 |
0 |
0 |
0.000 |
| 16 |
24 |
|
A |
2 |
1 |
11355 |
◊ |
A |
-y,-x,-z+1/2 |
8_555 |
2 |
1 |
11355 |
19.3 |
-0.4 |
0.345 |
0 |
0 |
0 |
0.000 |
| 17 |
25 |
|
[OHM]H:1001 |
1 |
1 |
578 |
◊ |
B |
-y-1/2,x+1/2,z-1/4 |
3_454 |
1 |
1 |
12323 |
4.6 |
0.2 |
0.575 |
0 |
0 |
0 |
0.000 |
26 |
|
H |
1 |
1 |
12417 |
◊ |
[OHM]B:1002 |
-y-1/2,x+1/2,z-1/4 |
3_454 |
1 |
1 |
581 |
2.8 |
0.1 |
0.562 |
0 |
0 |
0 |
0.000 |
| Average: |
3.7 |
0.2 |
0.568 |
0 |
0 |
0 |
0.000 |
|