## |
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 |
|
C |
92 |
24 |
8011 |
◊ |
B |
x,y,z |
1_555 |
95 |
25 |
8033 |
848.4 |
-18.3 |
0.013 |
8 |
0 |
0 |
0.185 |
2 |
|
D |
94 |
24 |
8079 |
◊ |
A |
x,y,z |
1_555 |
92 |
26 |
7999 |
839.8 |
-18.4 |
0.013 |
7 |
0 |
0 |
0.185 |
Average: |
844.1 |
-18.4 |
0.013 |
8 |
0 |
0 |
0.185 |
2 |
3 |
|
B |
41 |
13 |
8033 |
◊ |
A |
x,y,z |
1_555 |
40 |
13 |
7999 |
431.0 |
-3.6 |
0.358 |
5 |
0 |
0 |
0.023 |
3 |
4 |
|
D |
34 |
11 |
8079 |
◊ |
B |
x,y,z |
1_555 |
31 |
8 |
8033 |
305.3 |
-1.9 |
0.451 |
3 |
0 |
0 |
0.028 |
5 |
|
C |
33 |
10 |
8011 |
◊ |
A |
x,y,z |
1_555 |
31 |
8 |
7999 |
287.6 |
-2.1 |
0.450 |
4 |
0 |
0 |
0.028 |
Average: |
296.5 |
-2.0 |
0.450 |
4 |
0 |
0 |
0.028 |
4 |
6 |
|
C |
23 |
8 |
8011 |
◊ |
D |
-x+1,y-1/2,-z |
2_645 |
23 |
8 |
8079 |
244.0 |
-1.4 |
0.473 |
3 |
0 |
0 |
0.000 |
5 |
7 |
|
D |
29 |
11 |
8079 |
◊ |
C |
x-1,y,z-1 |
1_454 |
29 |
14 |
8011 |
239.4 |
-1.4 |
0.489 |
0 |
0 |
0 |
0.000 |
6 |
8 |
|
B |
22 |
6 |
8033 |
◊ |
D |
-x+1,y-1/2,-z |
2_645 |
29 |
7 |
8079 |
222.5 |
-1.9 |
0.416 |
2 |
0 |
0 |
0.000 |
9 |
|
C |
27 |
6 |
8011 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
25 |
8 |
7999 |
221.6 |
-1.7 |
0.460 |
1 |
0 |
0 |
0.000 |
Average: |
222.1 |
-1.8 |
0.438 |
2 |
0 |
0 |
0.000 |
7 |
10 |
|
[FMN]B:201 |
23 |
1 |
522 |
f |
C |
x,y,z |
1_555 |
23 |
7 |
8011 |
158.0 |
-0.6 |
0.418 |
1 |
0 |
0 |
0.014 |
11 |
|
[FMN]D:201 |
21 |
1 |
517 |
f |
D |
x,y,z |
1_555 |
20 |
6 |
8079 |
151.7 |
-0.8 |
0.377 |
2 |
0 |
0 |
0.014 |
Average: |
154.8 |
-0.7 |
0.398 |
2 |
0 |
0 |
0.014 |
8 |
12 |
|
D |
20 |
7 |
8079 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
19 |
8 |
7999 |
144.8 |
0.6 |
0.701 |
1 |
0 |
0 |
0.000 |
9 |
13 |
|
[FMN]B:201 |
21 |
1 |
522 |
◊ |
B |
x,y,z |
1_555 |
21 |
5 |
8033 |
142.8 |
-0.3 |
0.385 |
0 |
0 |
0 |
0.002 |
14 |
|
[FMN]D:201 |
20 |
1 |
517 |
◊ |
A |
x,y,z |
1_555 |
15 |
3 |
7999 |
123.2 |
-0.0 |
0.325 |
0 |
0 |
0 |
0.002 |
Average: |
133.0 |
-0.2 |
0.355 |
0 |
0 |
0 |
0.002 |
10 |
15 |
|
B |
12 |
5 |
8033 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
12 |
3 |
8011 |
105.1 |
1.7 |
0.806 |
2 |
0 |
0 |
0.000 |
11 |
16 |
|
D |
14 |
4 |
8079 |
◊ |
C |
-x+1,y-1/2,-z |
2_645 |
13 |
4 |
8011 |
104.2 |
1.1 |
0.770 |
0 |
1 |
0 |
0.000 |
12 |
17 |
|
B |
13 |
4 |
8033 |
◊ |
A |
x,y-1,z |
1_545 |
12 |
4 |
7999 |
77.1 |
0.2 |
0.664 |
0 |
0 |
0 |
0.000 |
13 |
18 |
|
[ZN]A:301 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
7999 |
54.1 |
-35.5 |
0.000 |
0 |
0 |
0 |
0.583 |
19 |
|
[ZN]B:301 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
11 |
7 |
8033 |
53.7 |
-35.2 |
0.000 |
0 |
0 |
0 |
0.583 |
20 |
|
[ZN]C:301 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
10 |
6 |
8011 |
52.3 |
-33.6 |
0.000 |
0 |
0 |
0 |
0.583 |
21 |
|
[ZN]D:301 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
13 |
7 |
8079 |
52.0 |
-33.8 |
0.000 |
0 |
0 |
0 |
0.583 |
Average: |
53.0 |
-34.5 |
0.000 |
0 |
0 |
0 |
0.583 |
14 |
22 |
|
[CA]D:302 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
11 |
6 |
8079 |
41.4 |
-9.1 |
0.000 |
0 |
0 |
0 |
0.148 |
23 |
|
[CA]C:302 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
10 |
6 |
8011 |
41.3 |
-9.1 |
0.000 |
0 |
0 |
0 |
0.148 |
24 |
|
[CA]B:302 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
8033 |
39.2 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.148 |
25 |
|
[CA]A:302 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
7999 |
38.4 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.148 |
Average: |
40.1 |
-8.7 |
0.000 |
0 |
0 |
0 |
0.148 |
15 |
26 |
|
[CA]A:302 |
1 |
1 |
85 |
◊ |
D |
x,y,z |
1_555 |
9 |
3 |
8079 |
29.0 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.076 |
27 |
|
[CA]B:302 |
1 |
1 |
85 |
◊ |
C |
x,y,z |
1_555 |
8 |
3 |
8011 |
28.9 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.076 |
28 |
|
[CA]D:302 |
1 |
1 |
85 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
7999 |
23.7 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.076 |
29 |
|
[CA]C:302 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
8033 |
23.3 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.076 |
Average: |
26.2 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.076 |
16 |
30 |
|
B |
2 |
1 |
8033 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
2 |
2 |
7999 |
12.8 |
0.1 |
0.673 |
0 |
0 |
0 |
0.000 |
17 |
31 |
|
[ZN]A:301 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
8033 |
7.3 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.020 |
32 |
|
[ZN]B:301 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
7999 |
5.5 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.020 |
Average: |
6.4 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.020 |
18 |
33 |
|
C |
1 |
1 |
8011 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
2 |
1 |
7999 |
6.8 |
0.4 |
0.832 |
0 |
0 |
0 |
0.000 |
19 |
34 |
|
B |
1 |
1 |
8033 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
1 |
1 |
8079 |
6.4 |
0.5 |
0.885 |
0 |
0 |
0 |
0.000 |
20 |
35 |
|
[FMN]B:201 |
1 |
1 |
522 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
1 |
1 |
7999 |
5.7 |
-0.2 |
0.304 |
0 |
0 |
0 |
0.000 |
21 |
36 |
|
D |
1 |
1 |
8079 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
8011 |
5.3 |
0.4 |
0.867 |
0 |
0 |
0 |
0.000 |
|