| ## |
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 |
138 |
36 |
10786 |
◊ |
A |
x,y,z |
1_555 |
133 |
36 |
10741 |
1317.4 |
-18.3 |
0.089 |
11 |
2 |
0 |
0.768 |
| 2 |
2 |
|
[KXO]A:202 |
27 |
1 |
594 |
f |
A |
x,y,z |
1_555 |
54 |
17 |
10741 |
399.6 |
5.9 |
0.322 |
2 |
0 |
0 |
0.000 |
| 3 |
3 |
|
[KXO]B:203 |
26 |
1 |
588 |
f |
B |
x,y,z |
1_555 |
61 |
19 |
10786 |
390.6 |
5.0 |
0.291 |
2 |
0 |
0 |
0.000 |
| 4 |
4 |
|
B |
42 |
11 |
10786 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
43 |
11 |
10741 |
348.1 |
2.3 |
0.869 |
4 |
5 |
0 |
0.000 |
| 5 |
5 |
|
[GSH]A:201 |
19 |
1 |
512 |
f |
A |
x,y,z |
1_555 |
44 |
15 |
10741 |
319.5 |
-3.3 |
0.728 |
9 |
0 |
0 |
0.473 |
6 |
|
[GSH]B:202 |
20 |
1 |
508 |
f |
B |
x,y,z |
1_555 |
43 |
14 |
10786 |
315.5 |
-3.2 |
0.731 |
9 |
0 |
0 |
0.473 |
| Average: |
317.5 |
-3.2 |
0.729 |
9 |
0 |
0 |
0.473 |
| 6 |
7 |
|
B |
35 |
11 |
10786 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
31 |
9 |
10741 |
291.5 |
0.4 |
0.740 |
3 |
0 |
0 |
0.000 |
| 7 |
8 |
|
B |
35 |
10 |
10786 |
◊ |
A |
-x,y-1/2,-z+1 |
2_546 |
27 |
10 |
10741 |
258.1 |
-1.7 |
0.499 |
3 |
0 |
0 |
0.000 |
| 8 |
9 |
|
B |
20 |
6 |
10786 |
x |
B |
-x,y-1/2,-z |
2_545 |
33 |
9 |
10786 |
211.5 |
-1.0 |
0.574 |
1 |
0 |
0 |
0.000 |
| 9 |
10 |
|
B |
25 |
10 |
10786 |
◊ |
A |
x,y,z-1 |
1_554 |
27 |
9 |
10741 |
197.3 |
0.9 |
0.771 |
2 |
0 |
0 |
0.000 |
| 10 |
11 |
|
B |
21 |
6 |
10786 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
24 |
6 |
10741 |
172.0 |
-0.3 |
0.628 |
1 |
0 |
0 |
0.000 |
| 11 |
12 |
|
A |
13 |
4 |
10741 |
x |
A |
x-1,y,z |
1_455 |
17 |
5 |
10741 |
145.9 |
-1.7 |
0.375 |
0 |
0 |
0 |
0.000 |
| 12 |
13 |
|
B |
18 |
6 |
10786 |
x |
B |
x-1,y,z |
1_455 |
17 |
4 |
10786 |
143.0 |
-1.4 |
0.433 |
0 |
0 |
0 |
0.000 |
| 13 |
14 |
|
[KXO]A:202 |
10 |
1 |
594 |
f |
[GSH]A:201 |
x,y,z |
1_555 |
6 |
1 |
512 |
79.7 |
-1.1 |
0.221 |
0 |
0 |
0 |
0.035 |
| 14 |
15 |
|
[KXO]B:203 |
7 |
1 |
588 |
f |
[GSH]B:202 |
x,y,z |
1_555 |
4 |
1 |
508 |
53.5 |
-0.3 |
0.287 |
0 |
0 |
0 |
0.009 |
| 15 |
16 |
|
[MG]B:201 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
8 |
4 |
10786 |
42.6 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.226 |
17 |
|
[MG]B:201 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
10741 |
41.3 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.226 |
| Average: |
41.9 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.226 |
| 16 |
18 |
|
[GSH]B:202 |
2 |
1 |
508 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
10741 |
39.3 |
0.2 |
0.684 |
1 |
0 |
0 |
0.013 |
19 |
|
[GSH]A:201 |
2 |
1 |
512 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
10786 |
38.5 |
0.3 |
0.687 |
1 |
0 |
0 |
0.013 |
| Average: |
38.9 |
0.3 |
0.685 |
1 |
0 |
0 |
0.013 |
| 17 |
20 |
|
B |
2 |
1 |
10786 |
x |
B |
-x+1,y-1/2,-z |
2_645 |
2 |
1 |
10786 |
37.1 |
-0.3 |
0.268 |
0 |
0 |
0 |
0.000 |
| 18 |
21 |
|
[KXO]B:203 |
2 |
1 |
588 |
◊ |
A |
x,y,z-1 |
1_554 |
2 |
1 |
10741 |
5.0 |
0.1 |
0.420 |
0 |
0 |
0 |
0.000 |
|