## |
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 |
|
D |
89 |
25 |
9037 |
◊ |
B |
x,y,z |
1_555 |
86 |
23 |
9129 |
776.4 |
-3.7 |
0.481 |
12 |
0 |
0 |
0.000 |
2 |
|
C |
89 |
26 |
9074 |
◊ |
A |
x,y,z |
1_555 |
84 |
23 |
9084 |
766.5 |
-3.0 |
0.534 |
13 |
0 |
0 |
0.000 |
Average: |
771.4 |
-3.3 |
0.507 |
13 |
0 |
0 |
0.000 |
2 |
3 |
|
C |
49 |
17 |
9074 |
◊ |
A |
-x+1/2,y-1/2,-z |
4_545 |
47 |
15 |
9084 |
486.0 |
-3.9 |
0.308 |
5 |
0 |
0 |
0.000 |
4 |
|
B |
47 |
15 |
9129 |
◊ |
D |
-x+1/2,y-1/2,-z+1 |
4_546 |
48 |
18 |
9037 |
480.6 |
-4.2 |
0.273 |
5 |
0 |
0 |
0.000 |
Average: |
483.3 |
-4.0 |
0.291 |
5 |
0 |
0 |
0.000 |
3 |
5 |
|
C |
45 |
16 |
9074 |
◊ |
B |
-x,y,-z |
2_555 |
46 |
13 |
9129 |
417.2 |
-0.6 |
0.630 |
10 |
0 |
0 |
0.000 |
4 |
6 |
|
[VN1]A:301 |
26 |
1 |
775 |
◊ |
A |
x,y,z |
1_555 |
52 |
24 |
9084 |
380.0 |
2.9 |
0.461 |
7 |
0 |
0 |
0.000 |
7 |
|
[VN1]B:301 |
28 |
1 |
783 |
◊ |
B |
x,y,z |
1_555 |
52 |
24 |
9129 |
368.7 |
2.4 |
0.465 |
6 |
0 |
0 |
0.000 |
8 |
|
[VN1]D:301 |
27 |
1 |
782 |
◊ |
D |
x,y,z |
1_555 |
54 |
24 |
9037 |
365.1 |
2.3 |
0.438 |
5 |
0 |
0 |
0.000 |
9 |
|
[VN1]C:301 |
24 |
1 |
776 |
◊ |
C |
x,y,z |
1_555 |
51 |
24 |
9074 |
352.0 |
2.9 |
0.510 |
6 |
0 |
0 |
0.000 |
Average: |
366.4 |
2.6 |
0.468 |
6 |
0 |
0 |
0.000 |
5 |
10 |
|
B |
41 |
14 |
9129 |
◊ |
A |
x,y,z |
1_555 |
41 |
14 |
9084 |
367.9 |
-0.4 |
0.661 |
4 |
0 |
0 |
0.000 |
6 |
11 |
|
C |
27 |
13 |
9074 |
◊ |
B |
x,y,z |
1_555 |
38 |
14 |
9129 |
290.3 |
-1.9 |
0.441 |
3 |
0 |
0 |
0.000 |
12 |
|
D |
29 |
12 |
9037 |
◊ |
A |
x,y,z |
1_555 |
34 |
12 |
9084 |
264.1 |
-1.9 |
0.426 |
2 |
0 |
0 |
0.000 |
Average: |
277.2 |
-1.9 |
0.434 |
3 |
0 |
0 |
0.000 |
7 |
13 |
|
D |
25 |
11 |
9037 |
◊ |
C |
-x,y,-z |
2_555 |
20 |
8 |
9074 |
214.0 |
-1.9 |
0.316 |
1 |
0 |
0 |
0.000 |
8 |
14 |
|
[VN1]C:301 |
16 |
1 |
776 |
f |
A |
x,y,z |
1_555 |
34 |
8 |
9084 |
208.5 |
-0.3 |
0.307 |
0 |
0 |
0 |
0.001 |
15 |
|
[VN1]D:301 |
15 |
1 |
782 |
f |
B |
x,y,z |
1_555 |
33 |
8 |
9129 |
207.0 |
0.4 |
0.397 |
0 |
0 |
0 |
0.001 |
16 |
|
[VN1]B:301 |
15 |
1 |
783 |
f |
D |
x,y,z |
1_555 |
33 |
8 |
9037 |
200.5 |
0.6 |
0.402 |
0 |
0 |
0 |
0.001 |
17 |
|
[VN1]A:301 |
15 |
1 |
775 |
f |
C |
x,y,z |
1_555 |
30 |
8 |
9074 |
199.2 |
0.3 |
0.341 |
0 |
0 |
0 |
0.001 |
Average: |
203.8 |
0.3 |
0.362 |
0 |
0 |
0 |
0.001 |
9 |
18 |
|
[GOL]D:302 |
6 |
1 |
220 |
◊ |
D |
x,y,z |
1_555 |
17 |
7 |
9037 |
118.5 |
0.8 |
0.695 |
5 |
0 |
0 |
0.000 |
10 |
19 |
|
[SO4]C:304 |
5 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
17 |
7 |
9074 |
99.2 |
-13.7 |
0.853 |
3 |
0 |
0 |
0.037 |
11 |
20 |
|
[SO4]D:304 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
14 |
6 |
9037 |
83.6 |
-11.4 |
0.719 |
2 |
0 |
0 |
0.037 |
12 |
21 |
|
D |
9 |
3 |
9037 |
◊ |
A |
-x,y,-z |
2_555 |
6 |
3 |
9084 |
80.8 |
-1.3 |
0.206 |
1 |
0 |
0 |
0.000 |
13 |
22 |
|
[SO4]A:303 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
9084 |
79.4 |
-10.6 |
0.676 |
2 |
0 |
0 |
0.047 |
14 |
23 |
|
[SO4]C:303 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
13 |
4 |
9074 |
79.4 |
-11.0 |
0.625 |
1 |
0 |
0 |
0.028 |
15 |
24 |
|
[GOL]D:302 |
5 |
1 |
220 |
f |
C |
-x,y,-z |
2_555 |
9 |
3 |
9074 |
68.7 |
-1.0 |
0.387 |
2 |
0 |
0 |
0.005 |
16 |
25 |
|
[CL]D:305 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
14 |
7 |
9037 |
66.9 |
-9.0 |
0.000 |
0 |
0 |
0 |
0.027 |
17 |
26 |
|
[CL]B:303 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
9129 |
54.9 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.035 |
18 |
27 |
|
[VN1]D:301 |
5 |
1 |
782 |
◊ |
[VN1]B:301 |
x,y,z |
1_555 |
4 |
1 |
783 |
46.9 |
0.2 |
0.328 |
0 |
0 |
0 |
0.000 |
28 |
|
[VN1]C:301 |
3 |
1 |
776 |
◊ |
[VN1]A:301 |
x,y,z |
1_555 |
5 |
1 |
775 |
46.9 |
3.0 |
0.764 |
0 |
0 |
0 |
0.000 |
Average: |
46.9 |
1.6 |
0.546 |
0 |
0 |
0 |
0.000 |
19 |
29 |
|
[CA]D:303 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
12 |
6 |
9037 |
45.5 |
-12.6 |
0.000 |
0 |
0 |
0 |
0.067 |
30 |
|
[CA]C:302 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
9 |
7 |
9074 |
43.8 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.067 |
31 |
|
[CA]A:302 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
4 |
4 |
9084 |
42.7 |
-12.6 |
0.000 |
0 |
0 |
0 |
0.067 |
32 |
|
[CA]B:302 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
3 |
3 |
9129 |
42.7 |
-12.6 |
0.000 |
0 |
0 |
0 |
0.067 |
Average: |
43.7 |
-12.6 |
0.000 |
0 |
0 |
0 |
0.067 |
|