| ## |
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 |
|
R |
371 |
98 |
19856 |
◊ |
B |
x,y,z |
1_555 |
359 |
91 |
12917 |
3510.3 |
-39.7 |
0.060 |
53 |
9 |
0 |
0.430 |
2 |
|
Q |
364 |
96 |
19708 |
◊ |
A |
x,y,z |
1_555 |
351 |
90 |
12749 |
3429.8 |
-41.0 |
0.035 |
53 |
7 |
0 |
0.430 |
3 |
|
S |
351 |
95 |
19696 |
◊ |
C |
x,y,z |
1_555 |
347 |
89 |
12533 |
3400.8 |
-40.2 |
0.039 |
50 |
7 |
0 |
0.430 |
| Average: |
3446.9 |
-40.3 |
0.045 |
52 |
8 |
0 |
0.430 |
| 2 |
4 |
|
Q |
76 |
25 |
19708 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
55 |
18 |
12749 |
554.8 |
-0.9 |
0.712 |
5 |
1 |
0 |
0.000 |
| 3 |
5 |
|
R |
62 |
24 |
19856 |
◊ |
C |
x,y,z |
1_555 |
57 |
19 |
12533 |
477.5 |
1.3 |
0.797 |
4 |
2 |
0 |
0.000 |
| 4 |
6 |
|
Q |
45 |
12 |
19708 |
◊ |
C |
x,y,z |
1_555 |
47 |
14 |
12533 |
416.2 |
-0.3 |
0.723 |
6 |
1 |
0 |
0.000 |
| 5 |
7 |
|
R |
49 |
17 |
19856 |
◊ |
Q |
x-1,y,z |
1_455 |
48 |
13 |
19708 |
410.3 |
-0.4 |
0.668 |
3 |
3 |
0 |
0.000 |
| 6 |
8 |
|
R |
37 |
11 |
19856 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
40 |
14 |
12749 |
337.5 |
-0.2 |
0.725 |
5 |
0 |
0 |
0.000 |
| 7 |
9 |
|
R |
26 |
7 |
19856 |
◊ |
S |
-x,y-1/2,-z+1 |
2_546 |
42 |
13 |
19696 |
294.0 |
0.4 |
0.719 |
4 |
2 |
0 |
0.000 |
| 8 |
10 |
|
S |
22 |
7 |
19696 |
x |
S |
-x,y-1/2,-z+1 |
2_546 |
28 |
7 |
19696 |
195.4 |
0.2 |
0.687 |
3 |
3 |
0 |
0.000 |
| 9 |
11 |
|
[SF4]B:265 |
8 |
1 |
309 |
f |
B |
x,y,z |
1_555 |
27 |
14 |
12917 |
186.7 |
-20.3 |
0.612 |
0 |
0 |
0 |
0.137 |
12 |
|
[SF4]A:265 |
8 |
1 |
309 |
f |
A |
x,y,z |
1_555 |
27 |
14 |
12749 |
186.4 |
-20.4 |
0.575 |
0 |
0 |
0 |
0.137 |
13 |
|
[SF4]C:265 |
8 |
1 |
308 |
f |
C |
x,y,z |
1_555 |
26 |
14 |
12533 |
184.4 |
-20.3 |
0.585 |
0 |
0 |
0 |
0.137 |
| Average: |
185.8 |
-20.3 |
0.591 |
0 |
0 |
0 |
0.137 |
| 10 |
14 |
|
S |
18 |
7 |
19696 |
◊ |
Q |
x,y,z |
1_555 |
26 |
7 |
19708 |
184.4 |
2.8 |
0.896 |
3 |
2 |
0 |
0.000 |
| 11 |
15 |
|
[F3S]A:266 |
7 |
1 |
301 |
f |
A |
x,y,z |
1_555 |
28 |
14 |
12749 |
173.8 |
-16.6 |
0.361 |
0 |
0 |
0 |
0.116 |
16 |
|
[F3S]C:266 |
7 |
1 |
301 |
f |
C |
x,y,z |
1_555 |
27 |
12 |
12533 |
172.5 |
-16.7 |
0.310 |
1 |
0 |
0 |
0.116 |
17 |
|
[F3S]B:266 |
7 |
1 |
298 |
f |
B |
x,y,z |
1_555 |
26 |
12 |
12917 |
170.2 |
-16.6 |
0.298 |
1 |
0 |
0 |
0.116 |
| Average: |
172.2 |
-16.6 |
0.323 |
1 |
0 |
0 |
0.116 |
| 12 |
18 |
|
[SF4]C:267 |
8 |
1 |
310 |
f |
C |
x,y,z |
1_555 |
33 |
16 |
12533 |
172.2 |
-18.7 |
0.239 |
1 |
0 |
0 |
0.130 |
19 |
|
[SF4]B:267 |
8 |
1 |
309 |
f |
B |
x,y,z |
1_555 |
31 |
16 |
12917 |
171.4 |
-18.6 |
0.211 |
1 |
0 |
0 |
0.130 |
20 |
|
[SF4]A:267 |
8 |
1 |
308 |
f |
A |
x,y,z |
1_555 |
29 |
14 |
12749 |
170.9 |
-18.7 |
0.203 |
1 |
0 |
0 |
0.130 |
| Average: |
171.5 |
-18.7 |
0.218 |
1 |
0 |
0 |
0.130 |
| 13 |
21 |
|
R |
23 |
10 |
19856 |
◊ |
Q |
x,y,z |
1_555 |
20 |
9 |
19708 |
166.8 |
-2.8 |
0.255 |
0 |
0 |
0 |
0.000 |
| 14 |
22 |
|
C |
17 |
5 |
12533 |
◊ |
S |
x-1,y,z |
1_455 |
23 |
11 |
19696 |
163.2 |
1.3 |
0.813 |
1 |
1 |
0 |
0.000 |
| 15 |
23 |
|
[GOL]S:561 |
6 |
1 |
218 |
f |
S |
x,y,z |
1_555 |
28 |
9 |
19696 |
148.7 |
-0.5 |
0.592 |
4 |
0 |
0 |
0.016 |
| 16 |
24 |
|
[GOL]Q:561 |
6 |
1 |
217 |
f |
Q |
x,y,z |
1_555 |
29 |
9 |
19708 |
146.9 |
-0.5 |
0.598 |
5 |
0 |
0 |
0.021 |
25 |
|
[GOL]R:563 |
6 |
1 |
214 |
f |
R |
x,y,z |
1_555 |
28 |
9 |
19856 |
143.6 |
-0.5 |
0.603 |
6 |
0 |
0 |
0.021 |
| Average: |
145.3 |
-0.5 |
0.600 |
6 |
0 |
0 |
0.021 |
| 17 |
26 |
|
Q |
14 |
6 |
19708 |
x |
Q |
x-1,y,z |
1_455 |
16 |
5 |
19708 |
138.3 |
0.0 |
0.649 |
1 |
2 |
0 |
0.000 |
| 18 |
27 |
|
[FCO]S:550 |
7 |
1 |
264 |
f |
S |
x,y,z |
1_555 |
17 |
11 |
19696 |
125.3 |
-1.6 |
0.331 |
0 |
0 |
0 |
0.013 |
28 |
|
[FCO]R:550 |
7 |
1 |
263 |
f |
R |
x,y,z |
1_555 |
16 |
10 |
19856 |
123.7 |
-1.9 |
0.323 |
0 |
0 |
0 |
0.013 |
29 |
|
[FCO]Q:550 |
7 |
1 |
263 |
f |
Q |
x,y,z |
1_555 |
14 |
8 |
19708 |
123.3 |
-0.6 |
0.531 |
0 |
0 |
0 |
0.013 |
| Average: |
124.1 |
-1.4 |
0.395 |
0 |
0 |
0 |
0.013 |
| 19 |
30 |
|
S |
18 |
5 |
19696 |
x |
S |
x-1,y,z |
1_455 |
18 |
6 |
19696 |
113.8 |
0.4 |
0.683 |
1 |
1 |
0 |
0.000 |
| 20 |
31 |
|
R |
15 |
7 |
19856 |
◊ |
S |
x,y-1,z |
1_545 |
16 |
7 |
19696 |
109.5 |
-0.4 |
0.489 |
0 |
0 |
0 |
0.000 |
| 21 |
32 |
|
[GOL]Q:562 |
6 |
1 |
218 |
f |
Q |
x,y,z |
1_555 |
18 |
6 |
19708 |
100.4 |
-0.2 |
0.592 |
7 |
0 |
0 |
0.021 |
| 22 |
33 |
|
[GOL]A:271 |
6 |
1 |
221 |
◊ |
A |
x,y,z |
1_555 |
12 |
4 |
12749 |
86.3 |
0.9 |
0.704 |
2 |
0 |
0 |
0.000 |
| 23 |
34 |
|
B |
12 |
6 |
12917 |
◊ |
S |
-x-1,y-1/2,-z+1 |
2_446 |
7 |
4 |
19696 |
78.8 |
0.2 |
0.635 |
0 |
0 |
0 |
0.000 |
| 24 |
35 |
|
C |
9 |
4 |
12533 |
◊ |
A |
x,y,z |
1_555 |
14 |
5 |
12749 |
77.2 |
-0.1 |
0.692 |
0 |
0 |
0 |
0.000 |
36 |
|
B |
11 |
5 |
12917 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
6 |
4 |
12749 |
65.8 |
-0.0 |
0.695 |
0 |
0 |
0 |
0.000 |
| Average: |
71.5 |
-0.0 |
0.694 |
0 |
0 |
0 |
0.000 |
| 25 |
37 |
|
B |
8 |
5 |
12917 |
◊ |
R |
x-1,y,z |
1_455 |
12 |
6 |
19856 |
69.1 |
1.0 |
0.796 |
0 |
0 |
0 |
0.000 |
| 26 |
38 |
|
[GOL]Q:562 |
6 |
1 |
218 |
◊ |
C |
x,y,z |
1_555 |
12 |
4 |
12533 |
63.7 |
-1.5 |
0.369 |
0 |
0 |
0 |
0.000 |
| 27 |
39 |
|
[SF4]B:267 |
4 |
1 |
309 |
◊ |
R |
x,y,z |
1_555 |
12 |
5 |
19856 |
61.9 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.032 |
40 |
|
[SF4]C:267 |
4 |
1 |
310 |
◊ |
S |
x,y,z |
1_555 |
12 |
5 |
19696 |
61.7 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.032 |
41 |
|
[SF4]A:267 |
4 |
1 |
308 |
◊ |
Q |
x,y,z |
1_555 |
12 |
5 |
19708 |
61.3 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.032 |
| Average: |
61.7 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.032 |
| 28 |
42 |
|
[F3S]B:266 |
5 |
1 |
298 |
◊ |
R |
x,y,z |
1_555 |
6 |
3 |
19856 |
54.6 |
-2.4 |
0.000 |
1 |
0 |
0 |
0.019 |
43 |
|
[F3S]A:266 |
5 |
1 |
301 |
◊ |
Q |
x,y,z |
1_555 |
7 |
3 |
19708 |
54.5 |
-2.4 |
0.000 |
1 |
0 |
0 |
0.019 |
44 |
|
[F3S]C:266 |
5 |
1 |
301 |
◊ |
S |
x,y,z |
1_555 |
7 |
3 |
19696 |
53.7 |
-2.4 |
0.000 |
1 |
0 |
0 |
0.019 |
| Average: |
54.3 |
-2.4 |
0.000 |
1 |
0 |
0 |
0.019 |
| 29 |
45 |
|
[MG]Q:553 |
1 |
1 |
98 |
f |
Q |
x,y,z |
1_555 |
12 |
6 |
19708 |
53.5 |
-9.5 |
0.000 |
0 |
0 |
0 |
0.064 |
46 |
|
[MG]S:553 |
1 |
1 |
98 |
f |
S |
x,y,z |
1_555 |
10 |
5 |
19696 |
53.1 |
-9.5 |
0.000 |
0 |
0 |
0 |
0.064 |
47 |
|
[MG]R:553 |
1 |
1 |
98 |
f |
R |
x,y,z |
1_555 |
10 |
5 |
19856 |
52.4 |
-9.5 |
0.000 |
0 |
0 |
0 |
0.064 |
| Average: |
53.0 |
-9.5 |
0.000 |
0 |
0 |
0 |
0.064 |
| 30 |
48 |
|
Q |
8 |
3 |
19708 |
f |
[GOL]A:271 |
-x,y-1/2,-z |
2_545 |
4 |
1 |
221 |
52.0 |
-1.0 |
0.336 |
0 |
0 |
0 |
0.007 |
| 31 |
49 |
|
C |
4 |
1 |
12533 |
◊ |
Q |
x-1,y,z |
1_455 |
5 |
2 |
19708 |
51.0 |
1.4 |
0.905 |
1 |
2 |
0 |
0.000 |
| 32 |
50 |
|
B |
6 |
2 |
12917 |
◊ |
S |
-x,y-1/2,-z+1 |
2_546 |
6 |
1 |
19696 |
50.3 |
0.5 |
0.779 |
1 |
0 |
0 |
0.000 |
| 33 |
51 |
|
[NI]Q:551 |
1 |
1 |
115 |
f |
[FCO]Q:550 |
x,y,z |
1_555 |
3 |
1 |
263 |
37.9 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.046 |
52 |
|
[NI]R:551 |
1 |
1 |
115 |
f |
[FCO]R:550 |
x,y,z |
1_555 |
3 |
1 |
263 |
37.4 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.046 |
53 |
|
[NI]S:551 |
1 |
1 |
115 |
f |
[FCO]S:550 |
x,y,z |
1_555 |
3 |
1 |
264 |
37.4 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.046 |
| Average: |
37.6 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.046 |
| 34 |
54 |
|
B |
8 |
4 |
12917 |
◊ |
S |
x,y-1,z |
1_545 |
8 |
5 |
19696 |
33.9 |
-0.9 |
0.439 |
0 |
0 |
0 |
0.000 |
| 35 |
55 |
|
R |
3 |
1 |
19856 |
◊ |
S |
-x-1,y-1/2,-z+1 |
2_446 |
4 |
1 |
19696 |
32.7 |
0.4 |
0.782 |
1 |
1 |
0 |
0.000 |
| 36 |
56 |
|
Q |
6 |
2 |
19708 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
6 |
3 |
12749 |
25.6 |
-0.2 |
0.565 |
0 |
0 |
0 |
0.000 |
| 37 |
57 |
|
R |
6 |
3 |
19856 |
◊ |
Q |
-x,y-1/2,-z |
2_545 |
6 |
3 |
19708 |
22.2 |
-0.0 |
0.646 |
0 |
0 |
0 |
0.000 |
| 38 |
58 |
|
[GOL]Q:562 |
1 |
1 |
218 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
12749 |
19.3 |
-0.1 |
0.230 |
0 |
0 |
0 |
0.000 |
| 39 |
59 |
|
R |
1 |
1 |
19856 |
◊ |
C |
x,y-1,z |
1_545 |
3 |
1 |
12533 |
9.9 |
0.3 |
0.765 |
0 |
0 |
0 |
0.000 |
|