| ## |
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 |
185 |
44 |
17051 |
◊ |
A |
-x,y,-z+1/2 |
3_555 |
185 |
42 |
16868 |
1739.6 |
-11.5 |
0.510 |
23 |
12 |
0 |
0.730 |
2 |
|
F |
169 |
42 |
16839 |
◊ |
C |
-x,y,-z+1/2 |
3_555 |
168 |
40 |
18031 |
1684.5 |
-16.9 |
0.242 |
10 |
6 |
0 |
0.730 |
3 |
|
B |
177 |
43 |
17712 |
◊ |
B |
-x,y,-z+1/2 |
3_555 |
176 |
43 |
17712 |
1665.4 |
-11.0 |
0.447 |
20 |
12 |
0 |
0.730 |
4 |
|
D |
173 |
42 |
17490 |
◊ |
D |
-x,y,-z+1/2 |
3_555 |
174 |
42 |
17490 |
1596.1 |
-17.1 |
0.178 |
18 |
2 |
0 |
0.730 |
| Average: |
1671.4 |
-14.1 |
0.344 |
18 |
8 |
0 |
0.730 |
| 2 |
5 |
|
C |
89 |
27 |
18031 |
◊ |
B |
x,y,z |
1_555 |
91 |
23 |
17712 |
804.0 |
5.0 |
0.937 |
16 |
11 |
0 |
0.264 |
6 |
|
E |
84 |
23 |
17051 |
◊ |
D |
x,y,z |
1_555 |
87 |
23 |
17490 |
803.5 |
4.7 |
0.931 |
18 |
11 |
0 |
0.264 |
7 |
|
D |
85 |
23 |
17490 |
◊ |
A |
x,y,z |
1_555 |
81 |
21 |
16868 |
767.5 |
-0.3 |
0.785 |
16 |
9 |
0 |
0.264 |
8 |
|
F |
80 |
20 |
16839 |
◊ |
B |
x,y,z |
1_555 |
84 |
21 |
17712 |
755.6 |
1.9 |
0.840 |
13 |
8 |
0 |
0.264 |
9 |
|
F |
79 |
20 |
16839 |
◊ |
E |
x,y,z |
1_555 |
85 |
21 |
17051 |
724.2 |
0.5 |
0.812 |
13 |
8 |
0 |
0.264 |
10 |
|
C |
81 |
20 |
18031 |
◊ |
A |
x,y,z |
1_555 |
78 |
19 |
16868 |
717.9 |
-1.0 |
0.763 |
15 |
6 |
0 |
0.264 |
| Average: |
762.1 |
1.8 |
0.845 |
15 |
9 |
0 |
0.264 |
| 3 |
11 |
|
[ADP]B:501 |
23 |
1 |
564 |
◊ |
B |
x,y,z |
1_555 |
48 |
19 |
17712 |
328.1 |
1.3 |
0.835 |
5 |
0 |
0 |
0.012 |
12 |
|
[ADP]F:501 |
24 |
1 |
540 |
◊ |
F |
x,y,z |
1_555 |
42 |
15 |
16839 |
300.6 |
1.5 |
0.866 |
5 |
0 |
0 |
0.012 |
| Average: |
314.4 |
1.4 |
0.850 |
5 |
0 |
0 |
0.012 |
| 4 |
13 |
|
[ADP]A:501 |
24 |
1 |
547 |
◊ |
A |
x,y,z |
1_555 |
46 |
19 |
16868 |
314.4 |
-0.4 |
0.748 |
5 |
0 |
0 |
0.032 |
14 |
|
[ADP]E:501 |
23 |
1 |
532 |
◊ |
E |
x,y,z |
1_555 |
42 |
17 |
17051 |
293.3 |
1.8 |
0.856 |
6 |
0 |
0 |
0.032 |
15 |
|
[ADP]C:501 |
24 |
1 |
552 |
◊ |
C |
x,y,z |
1_555 |
42 |
15 |
18031 |
291.8 |
1.3 |
0.819 |
5 |
0 |
0 |
0.032 |
| Average: |
299.8 |
0.9 |
0.808 |
5 |
0 |
0 |
0.032 |
| 5 |
16 |
|
[ADP]D:501 |
25 |
1 |
546 |
◊ |
D |
x,y,z |
1_555 |
48 |
19 |
17490 |
312.4 |
0.5 |
0.830 |
7 |
0 |
0 |
0.018 |
| 6 |
17 |
|
C |
24 |
9 |
18031 |
◊ |
C |
x,-y,-z |
4_555 |
24 |
9 |
18031 |
241.3 |
2.2 |
0.880 |
4 |
2 |
0 |
0.000 |
| 7 |
18 |
|
D |
21 |
7 |
17490 |
◊ |
C |
x-1/2,y-1/2,z |
5_445 |
27 |
11 |
18031 |
212.3 |
-3.1 |
0.227 |
3 |
3 |
0 |
0.000 |
19 |
|
F |
6 |
3 |
16839 |
◊ |
D |
x-1/2,y+1/2,z |
5_455 |
14 |
5 |
17490 |
89.1 |
-2.4 |
0.079 |
2 |
1 |
0 |
0.000 |
| Average: |
150.7 |
-2.7 |
0.153 |
3 |
2 |
0 |
0.000 |
| 8 |
20 |
|
E |
20 |
11 |
17051 |
◊ |
E |
-x-1,y,-z+1/2 |
3_455 |
19 |
11 |
17051 |
194.3 |
-4.1 |
0.133 |
0 |
0 |
0 |
0.000 |
| 9 |
21 |
|
C |
19 |
6 |
18031 |
◊ |
B |
x,-y,-z |
4_555 |
18 |
7 |
17712 |
183.9 |
-0.9 |
0.544 |
2 |
2 |
0 |
0.000 |
| 10 |
22 |
|
E |
11 |
5 |
17051 |
◊ |
A |
x-1/2,-y-1/2,-z |
8_445 |
10 |
5 |
16868 |
123.3 |
-1.0 |
0.347 |
0 |
0 |
0 |
0.000 |
| 11 |
23 |
|
[ADP]C:501 |
7 |
1 |
552 |
f |
A |
x,y,z |
1_555 |
15 |
5 |
16868 |
93.2 |
-5.1 |
0.265 |
0 |
0 |
0 |
0.156 |
| 12 |
24 |
|
D |
11 |
3 |
17490 |
◊ |
C |
x-1/2,-y-1/2,-z |
8_445 |
11 |
5 |
18031 |
90.3 |
-0.8 |
0.462 |
0 |
0 |
0 |
0.000 |
| 13 |
25 |
|
[ADP]A:501 |
7 |
1 |
547 |
f |
D |
x,y,z |
1_555 |
8 |
5 |
17490 |
81.2 |
-3.8 |
0.362 |
2 |
0 |
0 |
0.296 |
26 |
|
[ADP]F:501 |
8 |
1 |
540 |
f |
B |
x,y,z |
1_555 |
11 |
4 |
17712 |
75.4 |
-3.7 |
0.381 |
2 |
0 |
0 |
0.296 |
27 |
|
[ADP]D:501 |
8 |
1 |
546 |
f |
E |
x,y,z |
1_555 |
12 |
4 |
17051 |
70.4 |
-3.4 |
0.434 |
1 |
0 |
0 |
0.296 |
| Average: |
75.7 |
-3.6 |
0.393 |
2 |
0 |
0 |
0.296 |
| 14 |
28 |
|
[ADP]E:501 |
8 |
1 |
532 |
f |
F |
x,y,z |
1_555 |
12 |
5 |
16839 |
79.9 |
-3.0 |
0.447 |
1 |
0 |
0 |
0.114 |
| 15 |
29 |
|
[ADP]B:501 |
8 |
1 |
564 |
f |
C |
x,y,z |
1_555 |
15 |
6 |
18031 |
78.1 |
-4.3 |
0.362 |
1 |
0 |
0 |
0.156 |
| 16 |
30 |
|
F |
8 |
3 |
16839 |
◊ |
A |
x-1/2,-y-1/2,-z |
8_445 |
9 |
4 |
16868 |
55.3 |
-0.5 |
0.540 |
0 |
0 |
0 |
0.000 |
| 17 |
31 |
|
B |
4 |
2 |
17712 |
◊ |
A |
x-1/2,y+1/2,z |
5_455 |
3 |
1 |
16868 |
35.4 |
-0.8 |
0.263 |
0 |
0 |
0 |
0.000 |
32 |
|
E |
4 |
2 |
17051 |
◊ |
B |
x-1/2,y-1/2,z |
5_445 |
3 |
1 |
17712 |
29.1 |
-0.8 |
0.245 |
0 |
0 |
0 |
0.000 |
| Average: |
32.2 |
-0.8 |
0.254 |
0 |
0 |
0 |
0.000 |
| 18 |
33 |
|
B |
1 |
1 |
17712 |
◊ |
A |
x,-y,-z |
4_555 |
3 |
1 |
16868 |
12.6 |
-0.1 |
0.348 |
0 |
0 |
0 |
0.000 |
|