| ## |
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 |
76 |
19 |
16756 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
76 |
19 |
16959 |
700.5 |
-0.7 |
0.624 |
9 |
0 |
0 |
0.000 |
| 2 |
2 |
|
B |
60 |
22 |
16756 |
x |
B |
-x,y-1/2,-z+1 |
2_546 |
51 |
18 |
16756 |
505.7 |
-2.0 |
0.428 |
2 |
1 |
0 |
0.000 |
3 |
|
A |
45 |
16 |
16959 |
x |
A |
-x-1,y-1/2,-z |
2_445 |
50 |
21 |
16959 |
412.8 |
-2.1 |
0.392 |
3 |
1 |
0 |
0.000 |
| Average: |
459.2 |
-2.1 |
0.410 |
3 |
1 |
0 |
0.000 |
| 3 |
4 |
|
[QKA]B:401 |
26 |
1 |
623 |
f |
B |
x,y,z |
1_555 |
60 |
26 |
16756 |
418.3 |
3.1 |
0.453 |
4 |
0 |
0 |
0.000 |
5 |
|
[QKA]A:401 |
26 |
1 |
618 |
f |
A |
x,y,z |
1_555 |
60 |
26 |
16959 |
414.4 |
3.1 |
0.446 |
4 |
0 |
0 |
0.000 |
| Average: |
416.4 |
3.1 |
0.450 |
4 |
0 |
0 |
0.000 |
| 4 |
6 |
|
B |
48 |
16 |
16756 |
◊ |
A |
-x-1,y-1/2,-z |
2_445 |
41 |
9 |
16959 |
401.8 |
-4.4 |
0.210 |
6 |
1 |
0 |
0.000 |
| 5 |
7 |
|
B |
20 |
8 |
16756 |
◊ |
A |
x,y,z |
1_555 |
30 |
8 |
16959 |
223.4 |
1.3 |
0.722 |
1 |
3 |
0 |
0.000 |
| 6 |
8 |
|
[GOL]A:403 |
5 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
19 |
9 |
16959 |
117.8 |
-0.3 |
0.530 |
3 |
0 |
0 |
0.007 |
9 |
|
[GOL]B:403 |
6 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
18 |
8 |
16756 |
115.5 |
-0.3 |
0.552 |
3 |
0 |
0 |
0.007 |
| Average: |
116.6 |
-0.3 |
0.541 |
3 |
0 |
0 |
0.007 |
| 7 |
10 |
|
[GOL]A:402 |
6 |
1 |
220 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
16959 |
102.3 |
-0.1 |
0.556 |
1 |
0 |
0 |
0.002 |
11 |
|
[GOL]B:402 |
6 |
1 |
221 |
f |
B |
x,y,z |
1_555 |
15 |
8 |
16756 |
101.9 |
-0.1 |
0.559 |
1 |
0 |
0 |
0.002 |
| Average: |
102.1 |
-0.1 |
0.558 |
1 |
0 |
0 |
0.002 |
| 8 |
12 |
|
[GOL]B:404 |
5 |
1 |
221 |
f |
B |
x,y,z |
1_555 |
12 |
4 |
16756 |
99.7 |
-1.0 |
0.406 |
1 |
0 |
0 |
0.006 |
13 |
|
[GOL]A:404 |
6 |
1 |
220 |
f |
A |
x,y,z |
1_555 |
13 |
4 |
16959 |
99.1 |
-0.8 |
0.431 |
2 |
0 |
0 |
0.006 |
| Average: |
99.4 |
-0.9 |
0.418 |
2 |
0 |
0 |
0.006 |
| 9 |
14 |
|
[SO4]B:406 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
16959 |
89.1 |
-11.3 |
0.726 |
1 |
0 |
0 |
0.046 |
| 10 |
15 |
|
[GOL]B:402 |
5 |
1 |
221 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
12 |
5 |
16756 |
87.9 |
0.4 |
0.624 |
2 |
0 |
0 |
0.000 |
16 |
|
A |
12 |
5 |
16959 |
◊ |
[GOL]A:402 |
-x-1,y-1/2,-z |
2_445 |
5 |
1 |
220 |
87.3 |
0.4 |
0.625 |
2 |
0 |
0 |
0.000 |
| Average: |
87.6 |
0.4 |
0.624 |
2 |
0 |
0 |
0.000 |
| 11 |
17 |
|
[SO4]B:407 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
14 |
5 |
16756 |
84.5 |
-11.3 |
0.686 |
1 |
0 |
0 |
0.039 |
| 12 |
18 |
|
A |
6 |
2 |
16959 |
◊ |
B |
x,y,z-1 |
1_554 |
9 |
3 |
16756 |
77.7 |
-2.3 |
0.066 |
0 |
0 |
0 |
0.000 |
19 |
|
A |
7 |
2 |
16959 |
◊ |
B |
x-1,y,z |
1_455 |
6 |
2 |
16756 |
74.8 |
-2.3 |
0.062 |
0 |
0 |
0 |
0.000 |
| Average: |
76.2 |
-2.3 |
0.064 |
0 |
0 |
0 |
0.000 |
| 13 |
20 |
|
[SO4]A:405 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
16959 |
76.5 |
-10.1 |
0.892 |
3 |
0 |
0 |
0.045 |
| 14 |
21 |
|
[SO4]B:405 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
16756 |
72.3 |
-9.6 |
0.909 |
3 |
0 |
0 |
0.036 |
| 15 |
22 |
|
A |
8 |
3 |
16959 |
x |
A |
x-1,y,z |
1_455 |
7 |
2 |
16959 |
57.6 |
1.4 |
0.841 |
1 |
0 |
0 |
0.000 |
| 16 |
23 |
|
[SO4]B:407 |
4 |
1 |
187 |
f |
[QKA]B:401 |
x,y,z |
1_555 |
4 |
1 |
623 |
46.9 |
-5.4 |
0.651 |
0 |
0 |
0 |
0.018 |
| 17 |
24 |
|
B |
5 |
2 |
16756 |
◊ |
[GOL]B:403 |
-x,y-1/2,-z+1 |
2_546 |
5 |
1 |
219 |
39.9 |
0.3 |
0.621 |
0 |
0 |
0 |
0.000 |
25 |
|
[GOL]A:403 |
4 |
1 |
219 |
◊ |
A |
-x-1,y-1/2,-z |
2_445 |
4 |
2 |
16959 |
28.5 |
0.3 |
0.643 |
0 |
0 |
0 |
0.000 |
| Average: |
34.2 |
0.3 |
0.632 |
0 |
0 |
0 |
0.000 |
| 18 |
26 |
|
[SO4]B:406 |
4 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
16756 |
39.0 |
-3.6 |
0.956 |
1 |
0 |
0 |
0.000 |
| 19 |
27 |
|
A |
1 |
1 |
16959 |
x |
A |
-x,y-1/2,-z |
2_545 |
1 |
1 |
16959 |
9.2 |
0.0 |
0.422 |
0 |
0 |
0 |
0.000 |
|