| ## |
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 |
|
E |
212 |
58 |
12939 |
◊ |
D |
x,y,z |
1_555 |
210 |
59 |
11757 |
1936.7 |
-28.2 |
0.041 |
22 |
6 |
1 |
1.000 |
2 |
|
H |
198 |
55 |
12589 |
◊ |
G |
x,y,z |
1_555 |
215 |
56 |
11089 |
1843.8 |
-26.0 |
0.150 |
22 |
6 |
1 |
1.000 |
| Average: |
1890.3 |
-27.1 |
0.096 |
22 |
6 |
1 |
1.000 |
| 2 |
3 |
|
B |
126 |
31 |
6339 |
◊ |
A |
x,y,z |
1_555 |
140 |
41 |
14826 |
1221.3 |
-11.7 |
0.230 |
11 |
3 |
0 |
1.000 |
4 |
|
F |
119 |
29 |
6056 |
◊ |
C |
x,y,z |
1_555 |
132 |
36 |
14335 |
1165.2 |
-10.4 |
0.332 |
13 |
3 |
0 |
1.000 |
| Average: |
1193.3 |
-11.1 |
0.281 |
12 |
3 |
0 |
1.000 |
| 3 |
5 |
|
E |
98 |
32 |
12939 |
◊ |
A |
-x-1/2,y-1/2,-z+2 |
4_447 |
87 |
31 |
14826 |
861.7 |
-3.9 |
0.545 |
9 |
1 |
0 |
0.000 |
| 4 |
6 |
|
G |
64 |
17 |
11089 |
◊ |
A |
x,y,z |
1_555 |
70 |
17 |
14826 |
609.3 |
-3.0 |
0.590 |
10 |
2 |
0 |
0.107 |
7 |
|
D |
64 |
16 |
11757 |
◊ |
C |
x,y,z |
1_555 |
70 |
18 |
14335 |
603.7 |
-2.0 |
0.626 |
12 |
2 |
0 |
0.107 |
| Average: |
606.5 |
-2.5 |
0.608 |
11 |
2 |
0 |
0.107 |
| 5 |
8 |
|
C |
69 |
15 |
14335 |
◊ |
A |
x,y,z |
1_555 |
57 |
14 |
14826 |
594.7 |
-2.1 |
0.317 |
3 |
8 |
0 |
0.000 |
| 6 |
9 |
|
H |
69 |
18 |
12589 |
◊ |
A |
x,y,z |
1_555 |
68 |
20 |
14826 |
592.8 |
-3.1 |
0.620 |
10 |
1 |
0 |
0.115 |
10 |
|
E |
64 |
17 |
12939 |
◊ |
C |
x,y,z |
1_555 |
66 |
18 |
14335 |
567.3 |
-4.4 |
0.430 |
9 |
1 |
0 |
0.115 |
| Average: |
580.0 |
-3.8 |
0.525 |
10 |
1 |
0 |
0.115 |
| 7 |
11 |
|
D |
60 |
18 |
11757 |
◊ |
A |
x,y-1,z |
1_545 |
41 |
12 |
14826 |
468.0 |
-6.6 |
0.101 |
7 |
0 |
0 |
0.000 |
12 |
|
C |
40 |
12 |
14335 |
◊ |
G |
x-1/2,y-1/2,z |
3_445 |
58 |
18 |
11089 |
451.7 |
-6.2 |
0.141 |
8 |
0 |
0 |
0.000 |
| Average: |
459.9 |
-6.4 |
0.121 |
8 |
0 |
0 |
0.000 |
| 8 |
13 |
|
A |
34 |
9 |
14826 |
◊ |
H |
-x-1/2,y-1/2,-z+1 |
4_446 |
35 |
12 |
12589 |
336.5 |
1.5 |
0.807 |
5 |
6 |
0 |
0.000 |
| 9 |
14 |
|
B |
33 |
13 |
6339 |
◊ |
C |
x,y,z |
1_555 |
30 |
10 |
14335 |
267.9 |
-1.0 |
0.569 |
2 |
0 |
0 |
0.000 |
| 10 |
15 |
|
E |
30 |
10 |
12939 |
◊ |
G |
-x-1/2,y-1/2,-z+2 |
4_447 |
27 |
9 |
11089 |
256.4 |
-1.9 |
0.522 |
2 |
0 |
0 |
0.000 |
| 11 |
16 |
|
D |
23 |
8 |
11757 |
x |
D |
-x-1/2,y-1/2,-z+2 |
4_447 |
32 |
10 |
11757 |
253.4 |
1.0 |
0.789 |
4 |
0 |
0 |
0.000 |
| 12 |
17 |
|
[30W]C:600 |
16 |
1 |
389 |
cf |
C |
x,y,z |
1_555 |
47 |
15 |
14335 |
243.6 |
2.9 |
0.541 |
4 |
0 |
0 |
0.000 |
18 |
|
[30W]A:600 |
16 |
1 |
385 |
cf |
A |
x,y,z |
1_555 |
43 |
16 |
14826 |
235.9 |
2.9 |
0.546 |
4 |
0 |
0 |
0.000 |
| Average: |
239.8 |
2.9 |
0.543 |
4 |
0 |
0 |
0.000 |
| 13 |
19 |
|
H |
28 |
10 |
12589 |
◊ |
A |
-x-1/2,y-1/2,-z+1 |
4_446 |
23 |
9 |
14826 |
201.8 |
-2.6 |
0.391 |
0 |
0 |
0 |
0.000 |
| 14 |
20 |
|
D |
22 |
7 |
11757 |
◊ |
A |
-x-1/2,y-1/2,-z+2 |
4_447 |
23 |
8 |
14826 |
198.3 |
-2.3 |
0.379 |
0 |
0 |
0 |
0.000 |
| 15 |
21 |
|
H |
19 |
6 |
12589 |
◊ |
C |
-x-1,y,-z+1 |
2_456 |
19 |
5 |
14335 |
147.7 |
-0.3 |
0.657 |
5 |
0 |
0 |
0.000 |
| 16 |
22 |
|
D |
17 |
5 |
11757 |
◊ |
E |
-x-1/2,y-1/2,-z+2 |
4_447 |
11 |
3 |
12939 |
145.6 |
-1.6 |
0.343 |
1 |
1 |
0 |
0.000 |
| 17 |
23 |
|
D |
10 |
4 |
11757 |
◊ |
B |
x,y-1,z |
1_545 |
10 |
3 |
6339 |
81.1 |
0.1 |
0.659 |
1 |
0 |
0 |
0.000 |
| 18 |
24 |
|
E |
6 |
2 |
12939 |
◊ |
C |
-x-1,y,-z+2 |
2_457 |
6 |
2 |
14335 |
69.8 |
-1.0 |
0.309 |
0 |
0 |
0 |
0.000 |
| 19 |
25 |
|
H |
6 |
2 |
12589 |
x |
H |
-x-1/2,y-1/2,-z+1 |
4_446 |
7 |
3 |
12589 |
53.5 |
-0.3 |
0.587 |
0 |
0 |
0 |
0.000 |
| 20 |
26 |
|
[30W]A:600 |
7 |
1 |
385 |
◊ |
H |
x,y,z |
1_555 |
4 |
1 |
12589 |
37.1 |
0.1 |
0.337 |
0 |
0 |
0 |
0.000 |
27 |
|
[30W]C:600 |
7 |
1 |
389 |
◊ |
E |
x,y,z |
1_555 |
4 |
1 |
12939 |
34.7 |
0.2 |
0.341 |
0 |
0 |
0 |
0.000 |
| Average: |
35.9 |
0.2 |
0.339 |
0 |
0 |
0 |
0.000 |
| 21 |
28 |
|
[30W]C:600 |
7 |
1 |
389 |
◊ |
D |
x,y,z |
1_555 |
4 |
1 |
11757 |
36.0 |
0.1 |
0.331 |
1 |
0 |
0 |
0.004 |
29 |
|
[30W]A:600 |
7 |
1 |
385 |
◊ |
G |
x,y,z |
1_555 |
4 |
1 |
11089 |
35.0 |
0.1 |
0.337 |
1 |
0 |
0 |
0.004 |
| Average: |
35.5 |
0.1 |
0.334 |
1 |
0 |
0 |
0.004 |
| 22 |
30 |
|
F |
1 |
1 |
6056 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
6339 |
33.6 |
0.1 |
0.208 |
0 |
0 |
0 |
0.000 |
| 23 |
31 |
|
A |
6 |
4 |
14826 |
◊ |
G |
-x-1/2,y-1/2,-z+1 |
4_446 |
3 |
2 |
11089 |
28.8 |
-0.3 |
0.488 |
0 |
0 |
0 |
0.000 |
| 24 |
32 |
|
F |
2 |
1 |
6056 |
◊ |
G |
x-1/2,y-1/2,z |
3_445 |
2 |
1 |
11089 |
18.4 |
0.6 |
0.671 |
0 |
0 |
0 |
0.000 |
| 25 |
33 |
|
E |
1 |
1 |
12939 |
x |
E |
-x-1/2,y-1/2,-z+2 |
4_447 |
2 |
1 |
12939 |
5.5 |
-0.0 |
0.474 |
0 |
0 |
0 |
0.000 |
| 26 |
34 |
|
D |
1 |
1 |
11757 |
◊ |
B |
-x-1/2,y-1/2,-z+2 |
4_447 |
2 |
1 |
6339 |
4.9 |
0.2 |
0.731 |
0 |
0 |
0 |
0.000 |
| 27 |
35 |
|
C |
1 |
1 |
14335 |
◊ |
H |
x-1/2,y-1/2,z |
3_445 |
1 |
1 |
12589 |
4.8 |
-0.0 |
0.527 |
0 |
0 |
0 |
0.000 |
| 28 |
36 |
|
G |
3 |
2 |
11089 |
◊ |
G |
-x,y,-z+1 |
2_556 |
3 |
2 |
11089 |
0.8 |
-0.0 |
0.622 |
0 |
0 |
0 |
0.000 |
|