## |
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 |
155 |
43 |
16385 |
◊ |
A |
x,y,z |
1_555 |
160 |
47 |
16402 |
1436.1 |
-11.8 |
0.439 |
25 |
0 |
0 |
0.253 |
2 |
2 |
|
B |
37 |
14 |
16385 |
◊ |
A |
x-1,y,z |
1_455 |
37 |
12 |
16402 |
342.2 |
-3.1 |
0.441 |
3 |
0 |
0 |
0.000 |
3 |
3 |
|
A |
30 |
11 |
16402 |
x |
A |
-x,y-1/2,-z+1/2 |
4_545 |
25 |
8 |
16402 |
276.0 |
-2.5 |
0.388 |
2 |
0 |
0 |
0.000 |
4 |
4 |
|
A |
30 |
9 |
16402 |
◊ |
B |
-x,y-1/2,-z+1/2 |
4_545 |
29 |
11 |
16385 |
262.8 |
-4.6 |
0.174 |
0 |
0 |
0 |
0.000 |
5 |
5 |
|
[NAG]A:503 |
15 |
1 |
371 |
f |
A |
x,y,z |
1_555 |
53 |
19 |
16402 |
248.1 |
4.0 |
0.530 |
4 |
0 |
0 |
0.000 |
6 |
|
[NAG]B:503 |
15 |
1 |
370 |
f |
B |
x,y,z |
1_555 |
51 |
18 |
16385 |
247.2 |
4.8 |
0.546 |
5 |
0 |
0 |
0.000 |
Average: |
247.6 |
4.4 |
0.538 |
5 |
0 |
0 |
0.000 |
6 |
7 |
|
B |
31 |
13 |
16385 |
◊ |
A |
x-1/2,-y-1/2,-z |
3_445 |
21 |
9 |
16402 |
237.6 |
-3.2 |
0.312 |
1 |
0 |
0 |
0.000 |
7 |
8 |
|
[NAG]B:504 |
14 |
1 |
362 |
f |
B |
x,y,z |
1_555 |
44 |
19 |
16385 |
218.9 |
4.7 |
0.424 |
3 |
0 |
0 |
0.000 |
9 |
|
[NAG]A:504 |
14 |
1 |
361 |
f |
A |
x,y,z |
1_555 |
39 |
16 |
16402 |
215.7 |
5.1 |
0.431 |
6 |
0 |
0 |
0.000 |
Average: |
217.3 |
4.9 |
0.428 |
5 |
0 |
0 |
0.000 |
8 |
10 |
|
[EDO]B:505 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
19 |
7 |
16385 |
111.7 |
3.3 |
0.460 |
0 |
0 |
0 |
0.000 |
9 |
11 |
|
B |
12 |
5 |
16385 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
11 |
3 |
16402 |
95.4 |
-1.5 |
0.299 |
0 |
0 |
0 |
0.000 |
10 |
12 |
|
[EDO]A:505 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
16402 |
85.1 |
1.6 |
0.239 |
4 |
0 |
0 |
0.001 |
11 |
13 |
|
[EDO]B:506 |
4 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
15 |
6 |
16385 |
84.4 |
3.0 |
0.524 |
0 |
0 |
0 |
0.000 |
12 |
14 |
|
[EDO]A:508 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
16402 |
81.9 |
2.1 |
0.275 |
1 |
0 |
0 |
0.000 |
13 |
15 |
|
[EDO]A:506 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
16402 |
80.5 |
2.0 |
0.502 |
2 |
0 |
0 |
0.000 |
14 |
16 |
|
[EDO]A:507 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
16402 |
79.7 |
2.4 |
0.526 |
2 |
0 |
0 |
0.000 |
15 |
17 |
|
[EDO]A:507 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
9 |
3 |
16385 |
62.8 |
1.4 |
0.266 |
2 |
0 |
0 |
0.000 |
16 |
18 |
|
[NAG]B:504 |
6 |
1 |
362 |
cf |
[NAG]B:503 |
x,y,z |
1_555 |
9 |
1 |
370 |
61.3 |
2.2 |
0.108 |
0 |
0 |
0 |
0.000 |
19 |
|
[NAG]A:504 |
6 |
1 |
361 |
cf |
[NAG]A:503 |
x,y,z |
1_555 |
8 |
1 |
371 |
60.3 |
2.3 |
0.129 |
0 |
0 |
0 |
0.000 |
Average: |
60.8 |
2.2 |
0.118 |
0 |
0 |
0 |
0.000 |
17 |
20 |
|
[MG]B:502 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
15 |
7 |
16385 |
54.0 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.195 |
21 |
|
[MG]A:502 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
16402 |
51.4 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.195 |
Average: |
52.7 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.195 |
18 |
22 |
|
[ZN]A:501 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
7 |
5 |
16402 |
33.8 |
-24.2 |
0.000 |
0 |
0 |
0 |
0.523 |
23 |
|
[ZN]B:501 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
7 |
5 |
16385 |
33.1 |
-23.2 |
0.000 |
0 |
0 |
0 |
0.523 |
Average: |
33.4 |
-23.7 |
0.000 |
0 |
0 |
0 |
0.523 |
19 |
24 |
|
[EDO]A:506 |
3 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
8 |
4 |
16385 |
32.7 |
0.9 |
0.915 |
1 |
0 |
0 |
0.000 |
20 |
25 |
|
[NAG]A:504 |
4 |
1 |
361 |
f |
[ZN]A:501 |
x,y,z |
1_555 |
1 |
1 |
98 |
29.1 |
-13.3 |
0.000 |
0 |
0 |
0 |
0.300 |
26 |
|
[NAG]B:504 |
5 |
1 |
362 |
f |
[ZN]B:501 |
x,y,z |
1_555 |
1 |
1 |
98 |
29.0 |
-13.9 |
0.000 |
0 |
0 |
0 |
0.300 |
Average: |
29.0 |
-13.6 |
0.000 |
0 |
0 |
0 |
0.300 |
21 |
27 |
|
[EDO]B:506 |
3 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
6 |
2 |
16402 |
27.9 |
0.8 |
0.911 |
0 |
0 |
0 |
0.000 |
22 |
28 |
|
[EDO]B:506 |
3 |
1 |
183 |
f |
[EDO]A:506 |
x,y,z |
1_555 |
3 |
1 |
185 |
27.0 |
0.8 |
1.000 |
1 |
0 |
0 |
0.000 |
23 |
29 |
|
[EDO]A:508 |
4 |
1 |
185 |
f |
[EDO]A:506 |
x,y,z |
1_555 |
2 |
1 |
185 |
26.5 |
1.1 |
1.000 |
1 |
0 |
0 |
0.000 |
24 |
30 |
|
[EDO]B:506 |
3 |
1 |
183 |
f |
[EDO]A:507 |
x,y,z |
1_555 |
1 |
1 |
184 |
13.6 |
0.5 |
1.000 |
0 |
0 |
0 |
0.000 |
25 |
31 |
|
[EDO]A:508 |
2 |
1 |
185 |
f |
[MG]A:502 |
x,y,z |
1_555 |
1 |
1 |
98 |
13.6 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.012 |
26 |
32 |
|
[EDO]A:507 |
2 |
1 |
184 |
f |
[EDO]A:506 |
x,y,z |
1_555 |
2 |
1 |
185 |
9.3 |
0.3 |
1.000 |
0 |
0 |
0 |
0.000 |
27 |
33 |
|
[EDO]B:506 |
1 |
1 |
183 |
f |
[EDO]A:508 |
x,y,z |
1_555 |
1 |
1 |
185 |
6.1 |
0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
28 |
34 |
|
[NAG]B:503 |
2 |
1 |
370 |
f |
[ZN]B:501 |
x,y,z |
1_555 |
1 |
1 |
98 |
5.7 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.039 |
35 |
|
[NAG]A:503 |
2 |
1 |
371 |
f |
[ZN]A:501 |
x,y,z |
1_555 |
1 |
1 |
98 |
5.4 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.039 |
Average: |
5.6 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.039 |
|