## |
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 |
|
B |
69 |
20 |
9947 |
◊ |
A |
x,y,z |
1_555 |
74 |
23 |
10239 |
699.2 |
-3.5 |
0.371 |
12 |
3 |
0 |
0.000 |
2 |
|
B |
71 |
23 |
9947 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
66 |
18 |
10239 |
667.1 |
-4.0 |
0.364 |
11 |
6 |
0 |
0.000 |
Average: |
683.2 |
-3.7 |
0.368 |
12 |
5 |
0 |
0.000 |
2 |
3 |
|
B |
39 |
13 |
9947 |
x |
B |
-x-1,y-1/2,-z-1/2 |
3_444 |
34 |
9 |
9947 |
314.1 |
-1.6 |
0.460 |
1 |
0 |
0 |
0.000 |
3 |
4 |
|
[8YF]A:311 |
21 |
1 |
484 |
f |
A |
x,y,z |
1_555 |
47 |
16 |
10239 |
306.7 |
-6.5 |
0.275 |
9 |
0 |
0 |
0.014 |
4 |
5 |
|
A |
32 |
8 |
10239 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
40 |
12 |
10239 |
301.8 |
-1.1 |
0.516 |
2 |
0 |
0 |
0.000 |
5 |
6 |
|
[8YF]B:307 |
21 |
1 |
487 |
f |
B |
x,y,z |
1_555 |
47 |
16 |
9947 |
285.1 |
-6.2 |
0.278 |
8 |
0 |
0 |
0.011 |
6 |
7 |
|
A |
19 |
5 |
10239 |
x |
A |
x-1,y,z |
1_455 |
24 |
7 |
10239 |
186.7 |
-0.4 |
0.560 |
0 |
0 |
0 |
0.000 |
7 |
8 |
|
[EDO]A:307 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
17 |
9 |
10239 |
118.9 |
3.3 |
0.450 |
3 |
0 |
0 |
0.000 |
8 |
9 |
|
[EDO]B:306 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
23 |
10 |
9947 |
112.5 |
3.1 |
0.407 |
1 |
0 |
0 |
0.000 |
9 |
10 |
|
[EDO]A:310 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
17 |
6 |
10239 |
101.6 |
2.9 |
0.438 |
0 |
0 |
0 |
0.000 |
10 |
11 |
|
[EDO]B:304 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
22 |
9 |
10239 |
97.0 |
2.0 |
0.377 |
0 |
0 |
0 |
0.000 |
11 |
12 |
|
[EDO]B:303 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
9947 |
93.3 |
1.9 |
0.335 |
2 |
0 |
0 |
0.000 |
12 |
13 |
|
[EDO]A:303 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
14 |
7 |
10239 |
93.1 |
2.0 |
0.344 |
2 |
0 |
0 |
0.000 |
13 |
14 |
|
[EDO]A:304 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
10239 |
92.3 |
2.0 |
0.224 |
1 |
0 |
0 |
0.000 |
14 |
15 |
|
[EDO]A:306 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
19 |
6 |
10239 |
92.2 |
2.1 |
0.250 |
1 |
0 |
0 |
0.000 |
15 |
16 |
|
[EDO]A:309 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
15 |
5 |
10239 |
86.3 |
2.6 |
0.466 |
0 |
0 |
0 |
0.000 |
16 |
17 |
|
[EDO]A:308 |
4 |
1 |
181 |
◊ |
A |
x,y,z |
1_555 |
13 |
6 |
10239 |
85.5 |
3.0 |
0.305 |
1 |
0 |
0 |
0.000 |
17 |
18 |
|
[EDO]A:305 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
10239 |
73.9 |
1.4 |
0.699 |
2 |
0 |
0 |
0.000 |
18 |
19 |
|
[EDO]B:305 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
9947 |
70.6 |
1.7 |
0.834 |
3 |
0 |
0 |
0.000 |
19 |
20 |
|
[8YF]B:307 |
4 |
1 |
487 |
◊ |
A |
x,y,z |
1_555 |
7 |
4 |
10239 |
49.2 |
-0.3 |
0.511 |
0 |
0 |
0 |
0.000 |
20 |
21 |
|
[EDO]B:303 |
3 |
1 |
182 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
8 |
3 |
10239 |
46.3 |
1.3 |
0.262 |
0 |
0 |
0 |
0.000 |
21 |
22 |
|
[EDO]B:304 |
3 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
9947 |
45.0 |
1.3 |
0.822 |
3 |
0 |
0 |
0.000 |
22 |
23 |
|
[EDO]A:303 |
3 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
8 |
3 |
9947 |
42.6 |
1.2 |
0.763 |
0 |
0 |
0 |
0.000 |
23 |
24 |
|
[EDO]A:306 |
3 |
1 |
184 |
f |
[EDO]A:305 |
x,y,z |
1_555 |
2 |
1 |
184 |
38.4 |
2.2 |
0.707 |
0 |
0 |
0 |
0.000 |
24 |
25 |
|
[ZN]A:301 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
10239 |
33.0 |
-24.0 |
0.000 |
0 |
0 |
0 |
0.031 |
26 |
|
[ZN]B:301 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
5 |
9947 |
33.0 |
-24.7 |
0.000 |
0 |
0 |
0 |
0.031 |
Average: |
33.0 |
-24.4 |
0.000 |
0 |
0 |
0 |
0.031 |
25 |
27 |
|
[ZN]A:302 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
10239 |
32.8 |
-21.2 |
0.000 |
0 |
0 |
0 |
0.027 |
28 |
|
[ZN]B:302 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
6 |
9947 |
32.1 |
-21.1 |
0.000 |
0 |
0 |
0 |
0.027 |
Average: |
32.4 |
-21.2 |
0.000 |
0 |
0 |
0 |
0.027 |
26 |
29 |
|
B |
3 |
2 |
9947 |
◊ |
A |
-x-1,y-1/2,-z-1/2 |
3_444 |
5 |
2 |
10239 |
31.8 |
1.4 |
0.873 |
0 |
0 |
0 |
0.000 |
27 |
30 |
|
[8YF]A:311 |
7 |
1 |
484 |
f |
[ZN]A:302 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.9 |
-15.1 |
0.000 |
0 |
0 |
0 |
0.019 |
31 |
|
[8YF]B:307 |
7 |
1 |
487 |
f |
[ZN]B:302 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.0 |
-15.1 |
0.000 |
0 |
0 |
0 |
0.019 |
Average: |
30.5 |
-15.1 |
0.000 |
0 |
0 |
0 |
0.019 |
28 |
32 |
|
B |
3 |
1 |
9947 |
◊ |
A |
-x-3/2,-y,z-1/2 |
2_354 |
5 |
2 |
10239 |
30.9 |
0.5 |
0.763 |
0 |
0 |
0 |
0.000 |
29 |
33 |
|
[8YF]A:311 |
5 |
1 |
484 |
f |
[ZN]A:301 |
x,y,z |
1_555 |
1 |
1 |
98 |
29.6 |
-11.5 |
0.000 |
0 |
0 |
0 |
0.015 |
34 |
|
[8YF]B:307 |
5 |
1 |
487 |
f |
[ZN]B:301 |
x,y,z |
1_555 |
1 |
1 |
98 |
27.7 |
-11.3 |
0.000 |
0 |
0 |
0 |
0.015 |
Average: |
28.7 |
-11.4 |
0.000 |
0 |
0 |
0 |
0.015 |
30 |
35 |
|
[EDO]B:305 |
3 |
1 |
184 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
5 |
3 |
10239 |
27.0 |
1.5 |
0.936 |
0 |
0 |
0 |
0.000 |
31 |
36 |
|
B |
3 |
1 |
9947 |
◊ |
[8YF]A:311 |
-x-1/2,-y,z-1/2 |
2_454 |
4 |
1 |
484 |
26.0 |
-0.2 |
0.400 |
0 |
0 |
0 |
0.000 |
32 |
37 |
|
[EDO]B:306 |
2 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
3 |
1 |
10239 |
16.1 |
0.3 |
0.859 |
0 |
0 |
0 |
0.000 |
33 |
38 |
|
[8YF]B:307 |
2 |
1 |
487 |
f |
[EDO]B:304 |
x,y,z |
1_555 |
1 |
1 |
185 |
15.8 |
0.3 |
0.805 |
1 |
0 |
0 |
0.000 |
34 |
39 |
|
[EDO]A:309 |
3 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
2 |
2 |
9947 |
9.9 |
0.3 |
0.813 |
0 |
0 |
0 |
0.000 |
35 |
40 |
|
[ZN]B:302 |
1 |
1 |
98 |
f |
[ZN]B:301 |
x,y,z |
1_555 |
1 |
1 |
98 |
8.2 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.008 |
36 |
41 |
|
[ZN]A:302 |
1 |
1 |
98 |
f |
[ZN]A:301 |
x,y,z |
1_555 |
1 |
1 |
98 |
7.9 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.008 |
37 |
42 |
|
[EDO]A:308 |
2 |
1 |
181 |
f |
B |
x,y,z |
1_555 |
2 |
2 |
9947 |
3.4 |
0.2 |
0.858 |
0 |
0 |
0 |
0.000 |
38 |
43 |
|
[8YF]B:307 |
1 |
1 |
487 |
f |
[EDO]A:303 |
x,y,z |
1_555 |
1 |
1 |
183 |
2.3 |
0.2 |
0.756 |
0 |
0 |
0 |
0.000 |
|