| ## |
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 |
|
D |
62 |
19 |
10855 |
◊ |
A |
x,y,z |
1_555 |
58 |
18 |
10789 |
571.1 |
0.4 |
0.599 |
6 |
3 |
0 |
0.000 |
| 2 |
2 |
|
H |
57 |
19 |
10718 |
◊ |
D |
x,y,z |
1_555 |
54 |
18 |
10855 |
522.2 |
-5.6 |
0.143 |
4 |
3 |
0 |
0.000 |
3 |
|
F |
49 |
17 |
10770 |
◊ |
C |
x,y,z |
1_555 |
53 |
17 |
10741 |
494.2 |
-2.9 |
0.301 |
7 |
2 |
0 |
0.000 |
4 |
|
E |
49 |
17 |
10823 |
◊ |
A |
-x,y-1/2,-z+1 |
2_546 |
56 |
17 |
10789 |
489.3 |
-3.7 |
0.280 |
6 |
2 |
0 |
0.000 |
5 |
|
G |
48 |
17 |
10873 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
55 |
17 |
10778 |
483.3 |
-4.2 |
0.232 |
5 |
2 |
0 |
0.000 |
| Average: |
497.3 |
-4.1 |
0.239 |
6 |
2 |
0 |
0.000 |
| 3 |
6 |
|
E |
49 |
16 |
10823 |
◊ |
G |
-x,y-1/2,-z+1 |
2_546 |
51 |
14 |
10873 |
470.6 |
4.5 |
0.882 |
4 |
2 |
0 |
0.000 |
| 4 |
7 |
|
A |
45 |
12 |
10789 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
46 |
11 |
10778 |
397.5 |
-1.0 |
0.517 |
6 |
0 |
0 |
0.000 |
| 5 |
8 |
|
D |
38 |
13 |
10855 |
◊ |
G |
-x+1,y-1/2,-z+1 |
2_646 |
30 |
11 |
10873 |
336.0 |
-1.9 |
0.371 |
2 |
0 |
0 |
0.000 |
9 |
|
H |
33 |
11 |
10718 |
◊ |
F |
-x,y-1/2,-z+2 |
2_547 |
33 |
10 |
10770 |
310.3 |
-3.0 |
0.251 |
2 |
0 |
0 |
0.000 |
10 |
|
E |
33 |
10 |
10823 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
33 |
12 |
10741 |
308.1 |
-1.9 |
0.375 |
2 |
0 |
0 |
0.000 |
| Average: |
318.2 |
-2.3 |
0.332 |
2 |
0 |
0 |
0.000 |
| 6 |
11 |
|
[CBI]G:300 |
23 |
1 |
466 |
f |
G |
x,y,z |
1_555 |
56 |
18 |
10873 |
333.6 |
1.0 |
0.367 |
6 |
0 |
0 |
0.100 |
12 |
|
[CBI]C:300 |
23 |
1 |
464 |
f |
C |
x,y,z |
1_555 |
55 |
18 |
10741 |
330.2 |
1.6 |
0.438 |
7 |
0 |
0 |
0.100 |
13 |
|
[CBI]E:300 |
23 |
1 |
466 |
f |
E |
x,y,z |
1_555 |
53 |
18 |
10823 |
329.7 |
1.5 |
0.381 |
8 |
0 |
0 |
0.100 |
14 |
|
[CBI]D:300 |
23 |
1 |
464 |
f |
D |
x,y,z |
1_555 |
55 |
17 |
10855 |
329.2 |
1.5 |
0.384 |
8 |
0 |
0 |
0.100 |
15 |
|
[CBI]A:300 |
23 |
1 |
468 |
f |
A |
x,y,z |
1_555 |
55 |
18 |
10789 |
328.4 |
1.3 |
0.431 |
6 |
0 |
0 |
0.100 |
16 |
|
[CBI]H:300 |
23 |
1 |
465 |
f |
H |
x,y,z |
1_555 |
49 |
18 |
10718 |
326.8 |
1.2 |
0.403 |
8 |
0 |
0 |
0.100 |
17 |
|
[CBI]B:300 |
23 |
1 |
465 |
f |
B |
x,y,z |
1_555 |
54 |
18 |
10778 |
326.3 |
0.6 |
0.334 |
8 |
0 |
0 |
0.100 |
18 |
|
[CBI]F:300 |
23 |
1 |
467 |
f |
F |
x,y,z |
1_555 |
52 |
17 |
10770 |
325.0 |
1.5 |
0.395 |
8 |
0 |
0 |
0.100 |
| Average: |
328.6 |
1.3 |
0.392 |
7 |
0 |
0 |
0.100 |
| 7 |
19 |
|
E |
31 |
15 |
10823 |
◊ |
B |
x,y-1,z |
1_545 |
37 |
11 |
10778 |
327.8 |
0.2 |
0.540 |
4 |
3 |
0 |
0.000 |
20 |
|
G |
30 |
14 |
10873 |
◊ |
A |
x,y,z |
1_555 |
32 |
10 |
10789 |
279.6 |
1.8 |
0.765 |
2 |
3 |
0 |
0.000 |
| Average: |
303.7 |
1.0 |
0.652 |
3 |
3 |
0 |
0.000 |
| 8 |
21 |
|
C |
37 |
13 |
10741 |
◊ |
B |
x,y,z |
1_555 |
30 |
11 |
10778 |
315.7 |
1.6 |
0.636 |
5 |
2 |
0 |
0.000 |
| 9 |
22 |
|
C |
26 |
7 |
10741 |
◊ |
A |
x,y,z |
1_555 |
28 |
9 |
10789 |
216.8 |
-2.3 |
0.311 |
0 |
0 |
0 |
0.000 |
23 |
|
D |
25 |
8 |
10855 |
◊ |
F |
-x+1,y-1/2,-z+2 |
2_647 |
24 |
7 |
10770 |
208.5 |
-2.1 |
0.302 |
2 |
0 |
0 |
0.000 |
24 |
|
D |
27 |
8 |
10855 |
◊ |
B |
x,y-1,z |
1_545 |
24 |
8 |
10778 |
206.3 |
-2.5 |
0.250 |
0 |
0 |
0 |
0.000 |
25 |
|
E |
24 |
7 |
10823 |
◊ |
F |
-x,y-1/2,-z+1 |
2_546 |
30 |
9 |
10770 |
205.5 |
-1.9 |
0.343 |
0 |
0 |
0 |
0.000 |
26 |
|
H |
22 |
6 |
10718 |
◊ |
C |
-x+1,y-1/2,-z+2 |
2_647 |
27 |
9 |
10741 |
199.3 |
-2.0 |
0.329 |
0 |
0 |
0 |
0.000 |
27 |
|
H |
29 |
8 |
10718 |
◊ |
G |
-x,y-1/2,-z+1 |
2_546 |
22 |
7 |
10873 |
194.6 |
-1.9 |
0.338 |
0 |
0 |
0 |
0.000 |
| Average: |
205.2 |
-2.1 |
0.312 |
0 |
0 |
0 |
0.000 |
| 10 |
28 |
|
E |
11 |
4 |
10823 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
6 |
2 |
10778 |
83.6 |
0.5 |
0.705 |
0 |
0 |
0 |
0.000 |
| 11 |
29 |
|
A |
7 |
3 |
10789 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
10 |
4 |
10741 |
72.9 |
1.7 |
0.829 |
1 |
2 |
0 |
0.000 |
| 12 |
30 |
|
[CBI]A:300 |
3 |
1 |
468 |
◊ |
D |
x,y,z |
1_555 |
4 |
3 |
10855 |
37.8 |
0.3 |
0.459 |
0 |
0 |
0 |
0.000 |
| 13 |
31 |
|
F |
9 |
3 |
10770 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
10778 |
26.8 |
0.1 |
0.613 |
0 |
0 |
0 |
0.000 |
| 14 |
32 |
|
E |
4 |
2 |
10823 |
◊ |
C |
-x,y-1/2,-z+1 |
2_546 |
2 |
2 |
10741 |
26.5 |
-0.2 |
0.307 |
0 |
0 |
0 |
0.000 |
| 15 |
33 |
|
G |
3 |
2 |
10873 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
10778 |
21.4 |
1.2 |
0.924 |
0 |
0 |
0 |
0.000 |
| 16 |
34 |
|
E |
1 |
1 |
10823 |
◊ |
H |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
10718 |
3.8 |
0.2 |
0.811 |
0 |
0 |
0 |
0.000 |
|