## |
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 |
205 |
54 |
9831 |
◊ |
C |
x,y,z |
1_555 |
201 |
53 |
9829 |
1958.3 |
-11.6 |
0.382 |
35 |
4 |
0 |
0.749 |
2 |
|
H |
204 |
53 |
9843 |
◊ |
G |
x,y,z |
1_555 |
206 |
53 |
9937 |
1939.1 |
-11.7 |
0.351 |
33 |
5 |
0 |
0.749 |
3 |
|
B |
205 |
53 |
9881 |
◊ |
A |
x,y,z |
1_555 |
203 |
54 |
9933 |
1929.8 |
-13.1 |
0.307 |
31 |
3 |
0 |
0.749 |
4 |
|
F |
201 |
52 |
9828 |
◊ |
E |
x,y,z |
1_555 |
199 |
53 |
9856 |
1924.9 |
-12.2 |
0.320 |
33 |
6 |
0 |
0.749 |
Average: |
1938.0 |
-12.1 |
0.340 |
33 |
5 |
0 |
0.749 |
2 |
5 |
|
H |
88 |
28 |
9843 |
◊ |
C |
x,y,z |
1_555 |
85 |
26 |
9829 |
773.2 |
-6.0 |
0.343 |
13 |
8 |
0 |
0.398 |
6 |
|
F |
77 |
24 |
9828 |
◊ |
A |
x,y,z |
1_555 |
78 |
24 |
9933 |
737.6 |
-4.7 |
0.369 |
10 |
6 |
0 |
0.398 |
7 |
|
E |
78 |
24 |
9856 |
◊ |
B |
x,y,z |
1_555 |
76 |
24 |
9881 |
728.5 |
-5.2 |
0.369 |
11 |
6 |
0 |
0.398 |
8 |
|
G |
79 |
25 |
9937 |
◊ |
D |
x,y,z |
1_555 |
83 |
25 |
9831 |
725.0 |
-4.6 |
0.416 |
11 |
6 |
0 |
0.398 |
Average: |
741.1 |
-5.1 |
0.374 |
11 |
7 |
0 |
0.398 |
3 |
9 |
|
B |
48 |
16 |
9881 |
◊ |
E |
x-1/2,-y-1/2,-z |
4_445 |
50 |
13 |
9856 |
453.8 |
-1.0 |
0.487 |
7 |
0 |
0 |
0.000 |
4 |
10 |
|
G |
36 |
13 |
9937 |
◊ |
A |
x,y,z |
1_555 |
39 |
12 |
9933 |
342.1 |
-0.5 |
0.588 |
1 |
1 |
0 |
0.000 |
5 |
11 |
|
C |
38 |
10 |
9829 |
◊ |
D |
-x-1,y-1/2,-z+1/2 |
3_445 |
41 |
13 |
9831 |
337.3 |
-3.0 |
0.377 |
1 |
1 |
0 |
0.000 |
6 |
12 |
|
H |
37 |
11 |
9843 |
◊ |
D |
-x,y-1/2,-z+1/2 |
3_545 |
37 |
11 |
9831 |
310.3 |
-4.0 |
0.278 |
0 |
1 |
0 |
0.000 |
7 |
13 |
|
F |
33 |
10 |
9828 |
◊ |
B |
x,y,z |
1_555 |
33 |
11 |
9881 |
302.1 |
2.8 |
0.866 |
6 |
4 |
0 |
0.002 |
14 |
|
G |
34 |
11 |
9937 |
◊ |
C |
x,y,z |
1_555 |
32 |
10 |
9829 |
298.9 |
3.0 |
0.868 |
5 |
4 |
0 |
0.002 |
15 |
|
H |
35 |
11 |
9843 |
◊ |
D |
x,y,z |
1_555 |
33 |
11 |
9831 |
297.3 |
2.8 |
0.876 |
6 |
4 |
0 |
0.002 |
16 |
|
E |
28 |
9 |
9856 |
◊ |
A |
x,y,z |
1_555 |
29 |
9 |
9933 |
289.2 |
3.2 |
0.885 |
4 |
4 |
0 |
0.002 |
Average: |
296.9 |
2.9 |
0.874 |
5 |
4 |
0 |
0.002 |
8 |
17 |
|
H |
30 |
9 |
9843 |
◊ |
A |
x,y,z |
1_555 |
26 |
8 |
9933 |
243.1 |
-2.9 |
0.322 |
3 |
0 |
0 |
0.000 |
18 |
|
G |
26 |
8 |
9937 |
◊ |
B |
x,y,z |
1_555 |
28 |
9 |
9881 |
221.0 |
-2.5 |
0.365 |
2 |
0 |
0 |
0.000 |
Average: |
232.0 |
-2.7 |
0.344 |
3 |
0 |
0 |
0.000 |
9 |
19 |
|
B |
23 |
8 |
9881 |
◊ |
F |
x-1/2,-y-1/2,-z |
4_445 |
25 |
7 |
9828 |
202.7 |
-1.3 |
0.484 |
1 |
1 |
0 |
0.000 |
10 |
20 |
|
[C5J]D:301 |
7 |
1 |
230 |
f |
D |
x,y,z |
1_555 |
22 |
11 |
9831 |
122.6 |
1.5 |
0.421 |
8 |
0 |
0 |
0.100 |
21 |
|
[C5J]C:301 |
7 |
1 |
227 |
f |
C |
x,y,z |
1_555 |
25 |
11 |
9829 |
120.4 |
1.5 |
0.426 |
8 |
0 |
0 |
0.100 |
Average: |
121.5 |
1.5 |
0.423 |
8 |
0 |
0 |
0.100 |
11 |
22 |
|
[C5J]B:301 |
7 |
1 |
231 |
f |
B |
x,y,z |
1_555 |
24 |
12 |
9881 |
122.2 |
1.8 |
0.503 |
8 |
0 |
0 |
0.100 |
23 |
|
[C5J]H:301 |
7 |
1 |
228 |
f |
H |
x,y,z |
1_555 |
25 |
11 |
9843 |
121.8 |
1.8 |
0.502 |
8 |
0 |
0 |
0.100 |
24 |
|
[C5J]E:301 |
7 |
1 |
230 |
f |
E |
x,y,z |
1_555 |
24 |
11 |
9856 |
121.6 |
1.7 |
0.488 |
8 |
0 |
0 |
0.100 |
25 |
|
[C5J]G:301 |
7 |
1 |
229 |
f |
G |
x,y,z |
1_555 |
24 |
12 |
9937 |
121.4 |
1.7 |
0.479 |
8 |
0 |
0 |
0.100 |
26 |
|
[C5J]A:301 |
7 |
1 |
229 |
f |
A |
x,y,z |
1_555 |
24 |
12 |
9933 |
121.0 |
1.7 |
0.444 |
8 |
0 |
0 |
0.100 |
Average: |
121.6 |
1.8 |
0.483 |
8 |
0 |
0 |
0.100 |
12 |
27 |
|
[CA]C:303 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
12 |
7 |
9829 |
44.3 |
-8.5 |
0.000 |
0 |
0 |
0 |
0.261 |
13 |
28 |
|
[C5J]E:301 |
3 |
1 |
230 |
◊ |
F |
x,y,z |
1_555 |
4 |
2 |
9828 |
42.1 |
0.7 |
0.324 |
2 |
0 |
0 |
0.006 |
29 |
|
[C5J]A:301 |
3 |
1 |
229 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
9881 |
41.9 |
0.6 |
0.325 |
2 |
0 |
0 |
0.006 |
30 |
|
[C5J]G:301 |
3 |
1 |
229 |
◊ |
H |
x,y,z |
1_555 |
4 |
2 |
9843 |
41.2 |
0.7 |
0.327 |
2 |
0 |
0 |
0.006 |
Average: |
41.7 |
0.7 |
0.325 |
2 |
0 |
0 |
0.006 |
14 |
31 |
|
[C5J]B:301 |
3 |
1 |
231 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
9933 |
41.3 |
0.6 |
0.318 |
2 |
0 |
0 |
0.008 |
32 |
|
[C5J]H:301 |
3 |
1 |
228 |
◊ |
G |
x,y,z |
1_555 |
4 |
2 |
9937 |
39.6 |
0.6 |
0.320 |
2 |
0 |
0 |
0.008 |
Average: |
40.4 |
0.6 |
0.319 |
2 |
0 |
0 |
0.008 |
15 |
33 |
|
[C5J]C:301 |
3 |
1 |
227 |
◊ |
D |
x,y,z |
1_555 |
4 |
2 |
9831 |
39.5 |
0.9 |
0.480 |
2 |
0 |
0 |
0.000 |
34 |
|
[C5J]D:301 |
3 |
1 |
230 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
9829 |
38.9 |
1.0 |
0.386 |
2 |
0 |
0 |
0.000 |
Average: |
39.2 |
1.0 |
0.433 |
2 |
0 |
0 |
0.000 |
16 |
35 |
|
[CA]F:301 |
1 |
1 |
85 |
f |
F |
x,y,z |
1_555 |
14 |
6 |
9828 |
38.4 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.224 |
36 |
|
[CA]B:302 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
9881 |
38.1 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.224 |
37 |
|
[CA]C:302 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
12 |
6 |
9829 |
38.0 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.224 |
38 |
|
[CA]G:302 |
1 |
1 |
85 |
f |
G |
x,y,z |
1_555 |
12 |
6 |
9937 |
37.4 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.224 |
Average: |
38.0 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.224 |
17 |
39 |
|
[CA]G:302 |
1 |
1 |
85 |
◊ |
C |
x,y,z |
1_555 |
8 |
3 |
9829 |
35.7 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.102 |
40 |
|
[CA]B:302 |
1 |
1 |
85 |
◊ |
F |
x,y,z |
1_555 |
4 |
3 |
9828 |
33.0 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.102 |
41 |
|
[CA]F:301 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
9881 |
32.1 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.102 |
42 |
|
[CA]C:302 |
1 |
1 |
85 |
◊ |
G |
x,y,z |
1_555 |
7 |
3 |
9937 |
29.4 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.102 |
Average: |
32.5 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.102 |
18 |
43 |
|
H |
6 |
3 |
9843 |
◊ |
C |
-x,y-1/2,-z+1/2 |
3_545 |
6 |
4 |
9829 |
33.3 |
0.3 |
0.705 |
0 |
0 |
0 |
0.000 |
19 |
44 |
|
D |
4 |
2 |
9831 |
◊ |
H |
x-1,y,z |
1_455 |
5 |
1 |
9843 |
22.4 |
0.4 |
0.750 |
0 |
0 |
0 |
0.000 |
20 |
45 |
|
E |
1 |
1 |
9856 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
1 |
1 |
9881 |
17.2 |
-0.5 |
0.125 |
0 |
0 |
0 |
0.000 |
21 |
46 |
|
C |
5 |
3 |
9829 |
◊ |
H |
x-1,y,z |
1_455 |
4 |
1 |
9843 |
16.9 |
-0.2 |
0.547 |
0 |
0 |
0 |
0.000 |
22 |
47 |
|
H |
1 |
1 |
9843 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
9881 |
8.6 |
0.6 |
0.923 |
0 |
0 |
0 |
0.000 |
|