## |
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 |
101 |
28 |
11432 |
◊ |
A |
x,y,z |
1_555 |
93 |
24 |
11425 |
948.3 |
-16.4 |
0.017 |
10 |
1 |
0 |
0.517 |
2 |
|
F |
101 |
28 |
11431 |
◊ |
E |
x,y,z |
1_555 |
93 |
24 |
11436 |
945.5 |
-16.4 |
0.017 |
10 |
1 |
0 |
0.517 |
3 |
|
C |
93 |
24 |
11437 |
◊ |
A |
x,y,z |
1_555 |
104 |
28 |
11425 |
945.5 |
-16.4 |
0.018 |
10 |
1 |
0 |
0.517 |
4 |
|
F |
94 |
24 |
11431 |
◊ |
D |
x,y,z |
1_555 |
103 |
28 |
11441 |
945.4 |
-16.4 |
0.018 |
9 |
1 |
0 |
0.517 |
5 |
|
E |
101 |
27 |
11436 |
◊ |
D |
x,y,z |
1_555 |
93 |
24 |
11441 |
942.7 |
-15.2 |
0.030 |
9 |
1 |
0 |
0.517 |
6 |
|
C |
103 |
27 |
11437 |
◊ |
B |
x,y,z |
1_555 |
92 |
24 |
11432 |
936.5 |
-15.2 |
0.032 |
9 |
1 |
0 |
0.517 |
Average: |
944.0 |
-16.0 |
0.022 |
10 |
1 |
0 |
0.517 |
2 |
7 |
|
E |
52 |
11 |
11436 |
◊ |
B |
x,y,z |
1_555 |
52 |
11 |
11432 |
409.5 |
-5.6 |
0.246 |
8 |
0 |
0 |
0.105 |
8 |
|
D |
50 |
11 |
11441 |
◊ |
C |
x,y,z |
1_555 |
51 |
11 |
11437 |
408.5 |
-5.6 |
0.236 |
9 |
0 |
0 |
0.105 |
9 |
|
F |
50 |
11 |
11431 |
◊ |
A |
x,y,z |
1_555 |
50 |
11 |
11425 |
404.5 |
-5.5 |
0.238 |
8 |
0 |
0 |
0.105 |
Average: |
407.5 |
-5.6 |
0.240 |
8 |
0 |
0 |
0.105 |
3 |
10 |
|
D |
44 |
15 |
11441 |
◊ |
A |
-x+1/2,y-1/2,-z+1 |
3_546 |
44 |
18 |
11425 |
401.5 |
-4.7 |
0.227 |
1 |
0 |
0 |
0.000 |
11 |
|
F |
46 |
19 |
11431 |
◊ |
B |
-x+1/2,y-1/2,-z |
3_545 |
43 |
14 |
11432 |
391.5 |
-4.3 |
0.255 |
1 |
0 |
0 |
0.000 |
Average: |
396.5 |
-4.5 |
0.241 |
1 |
0 |
0 |
0.000 |
4 |
12 |
|
E |
36 |
15 |
11436 |
◊ |
E |
-x+1,-y,z |
2_655 |
36 |
15 |
11436 |
307.4 |
0.4 |
0.757 |
0 |
0 |
0 |
0.000 |
5 |
13 |
|
[XAN]A:400 |
11 |
1 |
280 |
f |
A |
x,y,z |
1_555 |
30 |
13 |
11425 |
185.7 |
3.8 |
0.522 |
4 |
0 |
0 |
0.000 |
14 |
|
[XAN]C:402 |
11 |
1 |
279 |
f |
C |
x,y,z |
1_555 |
30 |
13 |
11437 |
185.1 |
3.7 |
0.540 |
4 |
0 |
0 |
0.000 |
15 |
|
[XAN]E:404 |
11 |
1 |
278 |
f |
E |
x,y,z |
1_555 |
30 |
13 |
11436 |
184.9 |
3.7 |
0.517 |
4 |
0 |
0 |
0.000 |
16 |
|
[XAN]F:405 |
11 |
1 |
278 |
f |
F |
x,y,z |
1_555 |
30 |
13 |
11431 |
184.7 |
3.7 |
0.540 |
4 |
0 |
0 |
0.000 |
17 |
|
[XAN]B:401 |
11 |
1 |
279 |
f |
B |
x,y,z |
1_555 |
30 |
13 |
11432 |
184.1 |
3.7 |
0.523 |
4 |
0 |
0 |
0.000 |
18 |
|
[XAN]D:403 |
11 |
1 |
277 |
f |
D |
x,y,z |
1_555 |
30 |
13 |
11441 |
183.7 |
3.6 |
0.540 |
4 |
0 |
0 |
0.000 |
Average: |
184.7 |
3.7 |
0.530 |
4 |
0 |
0 |
0.000 |
6 |
19 |
|
[SO4]C:502 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
20 |
10 |
11437 |
110.4 |
-17.1 |
0.815 |
8 |
0 |
0 |
0.527 |
20 |
|
[SO4]E:504 |
5 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
20 |
10 |
11436 |
110.2 |
-17.0 |
0.815 |
8 |
0 |
0 |
0.527 |
21 |
|
[SO4]A:500 |
5 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
20 |
10 |
11425 |
109.7 |
-17.0 |
0.817 |
9 |
0 |
0 |
0.527 |
22 |
|
[SO4]B:501 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
20 |
10 |
11432 |
109.7 |
-17.2 |
0.814 |
8 |
0 |
0 |
0.527 |
23 |
|
[SO4]D:503 |
5 |
1 |
183 |
f |
D |
x,y,z |
1_555 |
20 |
10 |
11441 |
109.3 |
-17.0 |
0.815 |
8 |
0 |
0 |
0.527 |
24 |
|
[SO4]F:505 |
5 |
1 |
183 |
f |
F |
x,y,z |
1_555 |
20 |
10 |
11431 |
109.0 |
-17.0 |
0.815 |
9 |
0 |
0 |
0.527 |
Average: |
109.7 |
-17.1 |
0.815 |
8 |
0 |
0 |
0.527 |
7 |
25 |
|
E |
11 |
4 |
11436 |
◊ |
B |
-x+1,-y,z |
2_655 |
12 |
4 |
11432 |
85.3 |
-0.4 |
0.574 |
0 |
0 |
0 |
0.000 |
8 |
26 |
|
F |
6 |
2 |
11431 |
◊ |
F |
-x,-y,z |
2_555 |
6 |
2 |
11431 |
52.9 |
0.8 |
0.827 |
0 |
0 |
0 |
0.000 |
9 |
27 |
|
B |
1 |
1 |
11432 |
◊ |
D |
x,y,z-1 |
1_554 |
1 |
1 |
11441 |
22.1 |
0.5 |
0.909 |
0 |
0 |
0 |
0.000 |
10 |
28 |
|
E |
3 |
1 |
11436 |
◊ |
A |
-x+1/2,y-1/2,-z |
3_545 |
1 |
1 |
11425 |
7.5 |
-0.1 |
0.417 |
0 |
0 |
0 |
0.000 |
29 |
|
F |
1 |
1 |
11431 |
◊ |
C |
-x+1/2,y-1/2,-z+1 |
3_546 |
1 |
1 |
11437 |
1.1 |
-0.0 |
0.592 |
0 |
0 |
0 |
0.000 |
Average: |
4.3 |
-0.0 |
0.505 |
0 |
0 |
0 |
0.000 |
11 |
30 |
|
E |
1 |
1 |
11436 |
◊ |
D |
-x+1,-y,z |
2_655 |
2 |
1 |
11441 |
7.3 |
-0.2 |
0.316 |
0 |
0 |
0 |
0.000 |
12 |
31 |
|
[XAN]D:403 |
1 |
1 |
277 |
f |
[SO4]D:503 |
x,y,z |
1_555 |
1 |
1 |
183 |
1.9 |
-0.2 |
1.000 |
0 |
0 |
0 |
0.005 |
32 |
|
[XAN]B:401 |
1 |
1 |
279 |
f |
[SO4]B:501 |
x,y,z |
1_555 |
1 |
1 |
184 |
1.8 |
-0.2 |
1.000 |
0 |
0 |
0 |
0.005 |
33 |
|
[XAN]C:402 |
1 |
1 |
279 |
f |
[SO4]C:502 |
x,y,z |
1_555 |
1 |
1 |
185 |
1.7 |
-0.2 |
1.000 |
0 |
0 |
0 |
0.005 |
34 |
|
[XAN]A:400 |
1 |
1 |
280 |
f |
[SO4]A:500 |
x,y,z |
1_555 |
1 |
1 |
183 |
1.7 |
-0.2 |
1.000 |
0 |
0 |
0 |
0.005 |
35 |
|
[XAN]E:404 |
1 |
1 |
278 |
f |
[SO4]E:504 |
x,y,z |
1_555 |
1 |
1 |
185 |
1.6 |
-0.2 |
1.000 |
0 |
0 |
0 |
0.005 |
36 |
|
[XAN]F:405 |
1 |
1 |
278 |
f |
[SO4]F:505 |
x,y,z |
1_555 |
1 |
1 |
183 |
1.3 |
-0.1 |
1.000 |
0 |
0 |
0 |
0.005 |
Average: |
1.7 |
-0.2 |
1.000 |
0 |
0 |
0 |
0.005 |
|