| ## |
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 |
211 |
54 |
14688 |
◊ |
C |
-x+y+1,y,-z+7/3 |
5_657 |
213 |
54 |
14688 |
2041.4 |
-25.0 |
0.059 |
22 |
12 |
0 |
0.164 |
2 |
|
B |
211 |
54 |
14718 |
◊ |
A |
-x+y+1,y,-z+7/3 |
5_657 |
215 |
54 |
14767 |
2016.6 |
-26.4 |
0.049 |
21 |
11 |
0 |
0.164 |
| Average: |
2029.0 |
-25.7 |
0.054 |
22 |
12 |
0 |
0.164 |
| 2 |
3 |
|
C |
69 |
22 |
14688 |
◊ |
A |
x,y,z |
1_555 |
71 |
18 |
14767 |
667.8 |
-1.9 |
0.570 |
9 |
4 |
0 |
0.043 |
4 |
|
B |
71 |
18 |
14718 |
◊ |
A |
x,y,z |
1_555 |
73 |
23 |
14767 |
664.4 |
-2.2 |
0.574 |
9 |
3 |
0 |
0.043 |
5 |
|
C |
73 |
17 |
14688 |
◊ |
B |
x,y,z |
1_555 |
72 |
23 |
14718 |
654.0 |
-2.7 |
0.517 |
9 |
3 |
0 |
0.043 |
| Average: |
662.1 |
-2.3 |
0.554 |
9 |
3 |
0 |
0.043 |
| 3 |
6 |
|
A |
42 |
10 |
14767 |
◊ |
A |
x,x-y+1,-z+2 |
6_567 |
42 |
10 |
14767 |
344.5 |
-2.3 |
0.513 |
8 |
0 |
0 |
0.000 |
| 4 |
7 |
|
[RUB]A:401 |
18 |
1 |
454 |
f |
A |
x,y,z |
1_555 |
47 |
23 |
14767 |
310.6 |
-6.8 |
0.599 |
16 |
0 |
0 |
0.132 |
8 |
|
[RUB]C:401 |
18 |
1 |
448 |
f |
C |
x,y,z |
1_555 |
49 |
25 |
14688 |
301.4 |
-7.4 |
0.537 |
17 |
0 |
0 |
0.132 |
| Average: |
306.0 |
-7.1 |
0.568 |
17 |
0 |
0 |
0.132 |
| 5 |
9 |
|
[RUB]B:401 |
18 |
1 |
453 |
f |
B |
x,y,z |
1_555 |
49 |
24 |
14718 |
305.9 |
-6.5 |
0.585 |
17 |
0 |
0 |
0.062 |
| 6 |
10 |
|
A |
29 |
9 |
14767 |
◊ |
A |
-x+y+1,y,-z+7/3 |
5_657 |
29 |
9 |
14767 |
253.8 |
3.2 |
0.910 |
2 |
4 |
0 |
0.002 |
11 |
|
C |
24 |
7 |
14688 |
◊ |
B |
-x+y+1,y,-z+7/3 |
5_657 |
27 |
8 |
14718 |
213.7 |
0.3 |
0.667 |
1 |
3 |
0 |
0.002 |
| Average: |
233.8 |
1.8 |
0.789 |
2 |
4 |
0 |
0.002 |
| 7 |
12 |
|
C |
23 |
6 |
14688 |
◊ |
C |
-x+y+2,y,-z+7/3 |
5_757 |
23 |
6 |
14688 |
229.2 |
-0.6 |
0.610 |
4 |
4 |
0 |
0.000 |
13 |
|
B |
23 |
6 |
14718 |
◊ |
A |
-x+y+2,y,-z+7/3 |
5_757 |
24 |
7 |
14767 |
209.7 |
-0.6 |
0.622 |
6 |
4 |
0 |
0.000 |
| Average: |
219.4 |
-0.6 |
0.616 |
5 |
4 |
0 |
0.000 |
| 8 |
14 |
|
[AMP]C:403 |
20 |
1 |
484 |
◊ |
A |
x,y,z |
1_555 |
33 |
13 |
14767 |
214.1 |
0.2 |
0.537 |
3 |
0 |
0 |
0.007 |
15 |
|
[AMP]A:403 |
20 |
1 |
485 |
◊ |
B |
x,y,z |
1_555 |
29 |
13 |
14718 |
212.5 |
0.4 |
0.505 |
3 |
0 |
0 |
0.007 |
16 |
|
[AMP]B:403 |
20 |
1 |
485 |
◊ |
C |
x,y,z |
1_555 |
34 |
14 |
14688 |
210.3 |
0.2 |
0.527 |
3 |
0 |
0 |
0.007 |
| Average: |
212.3 |
0.3 |
0.523 |
3 |
0 |
0 |
0.007 |
| 9 |
17 |
|
[AMP]B:403 |
19 |
1 |
485 |
f |
B |
x,y,z |
1_555 |
19 |
5 |
14718 |
164.7 |
-1.7 |
0.604 |
5 |
0 |
0 |
0.033 |
18 |
|
[AMP]C:403 |
17 |
1 |
484 |
f |
C |
x,y,z |
1_555 |
18 |
5 |
14688 |
163.1 |
-2.0 |
0.576 |
4 |
0 |
0 |
0.033 |
19 |
|
[AMP]A:403 |
18 |
1 |
485 |
f |
A |
x,y,z |
1_555 |
18 |
5 |
14767 |
159.5 |
-1.6 |
0.577 |
3 |
0 |
0 |
0.033 |
| Average: |
162.5 |
-1.7 |
0.586 |
4 |
0 |
0 |
0.033 |
| 10 |
20 |
|
[K]C:402 |
1 |
1 |
216 |
f |
C |
x,y,z |
1_555 |
18 |
8 |
14688 |
108.6 |
-76.6 |
0.000 |
0 |
0 |
0 |
0.674 |
21 |
|
[K]B:402 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
15 |
8 |
14718 |
105.3 |
-72.4 |
0.000 |
0 |
0 |
0 |
0.674 |
22 |
|
[K]A:402 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
14767 |
104.6 |
-72.4 |
0.000 |
0 |
0 |
0 |
0.674 |
| Average: |
106.2 |
-73.8 |
0.000 |
0 |
0 |
0 |
0.674 |
| 11 |
23 |
|
B |
14 |
5 |
14718 |
◊ |
A |
-y+2,x-y+1,z+1/3 |
2_765 |
12 |
3 |
14767 |
95.3 |
-0.6 |
0.556 |
0 |
0 |
0 |
0.000 |
| 12 |
24 |
|
[MPD]A:404 |
5 |
1 |
275 |
f |
B |
-x+y+1,y,-z+7/3 |
5_657 |
11 |
4 |
14718 |
87.8 |
-5.6 |
0.535 |
0 |
0 |
0 |
0.025 |
| 13 |
25 |
|
[MPD]A:404 |
6 |
1 |
275 |
◊ |
A |
x,y,z |
1_555 |
13 |
4 |
14767 |
81.8 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.023 |
| 14 |
26 |
|
[AMP]A:403 |
5 |
1 |
485 |
◊ |
A |
-x+y+1,y,-z+7/3 |
5_657 |
5 |
3 |
14767 |
66.7 |
-1.5 |
0.347 |
4 |
0 |
0 |
0.025 |
27 |
|
[AMP]B:403 |
5 |
1 |
485 |
◊ |
C |
-x+y+1,y,-z+7/3 |
5_657 |
6 |
3 |
14688 |
61.8 |
-2.5 |
0.327 |
1 |
0 |
0 |
0.025 |
28 |
|
[AMP]C:403 |
5 |
1 |
484 |
◊ |
B |
-x+y+1,y,-z+7/3 |
5_657 |
5 |
2 |
14718 |
50.4 |
-1.5 |
0.427 |
3 |
0 |
0 |
0.025 |
| Average: |
59.6 |
-1.8 |
0.367 |
3 |
0 |
0 |
0.025 |
| 15 |
29 |
|
B |
3 |
1 |
14718 |
◊ |
C |
x-1,y-1,z |
1_445 |
5 |
3 |
14688 |
46.0 |
-1.1 |
0.194 |
0 |
0 |
0 |
0.000 |
| 16 |
30 |
|
[K]A:402 |
1 |
1 |
216 |
◊ |
A |
-x+y+1,y,-z+7/3 |
5_657 |
6 |
2 |
14767 |
37.9 |
-18.7 |
0.000 |
0 |
0 |
0 |
0.147 |
31 |
|
[K]B:402 |
1 |
1 |
216 |
◊ |
C |
-x+y+1,y,-z+7/3 |
5_657 |
9 |
2 |
14688 |
37.0 |
-18.1 |
0.000 |
0 |
0 |
0 |
0.147 |
32 |
|
[K]C:402 |
1 |
1 |
216 |
◊ |
B |
-x+y+1,y,-z+7/3 |
5_657 |
5 |
2 |
14718 |
26.8 |
-12.9 |
0.000 |
0 |
0 |
0 |
0.147 |
| Average: |
33.9 |
-16.6 |
0.000 |
0 |
0 |
0 |
0.147 |
| 17 |
33 |
|
[K]C:402 |
1 |
1 |
216 |
◊ |
[K]B:402 |
-x+y+1,y,-z+7/3 |
5_657 |
1 |
1 |
216 |
35.8 |
-35.8 |
0.000 |
0 |
0 |
0 |
0.135 |
| 18 |
34 |
|
[K]A:402 |
1 |
1 |
216 |
◊ |
[K]A:402 |
-x+y+1,y,-z+7/3 |
5_657 |
1 |
1 |
216 |
34.0 |
-34.0 |
0.000 |
0 |
0 |
0 |
0.134 |
| 19 |
35 |
|
A |
2 |
2 |
14767 |
◊ |
C |
-x+y+1,y-1,-z+7/3 |
5_647 |
2 |
1 |
14688 |
20.6 |
0.6 |
0.608 |
0 |
0 |
0 |
0.000 |
| 20 |
36 |
|
[MPD]A:404 |
1 |
1 |
275 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
14688 |
11.3 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.002 |
| 21 |
37 |
|
B |
1 |
1 |
14718 |
◊ |
C |
x,y-1,z |
1_545 |
3 |
1 |
14688 |
8.0 |
0.2 |
0.791 |
0 |
0 |
0 |
0.000 |
| 22 |
38 |
|
B |
2 |
1 |
14718 |
◊ |
A |
-y+2,x-y,z+1/3 |
2_755 |
1 |
1 |
14767 |
7.6 |
-0.2 |
0.372 |
0 |
0 |
0 |
0.000 |
| 23 |
39 |
|
[MPD]A:404 |
1 |
1 |
275 |
◊ |
A |
-x+y+1,y,-z+7/3 |
5_657 |
1 |
1 |
14767 |
3.6 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
|