## |
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 |
59 |
17 |
7473 |
◊ |
A |
x,y,z |
1_555 |
58 |
17 |
7533 |
614.1 |
5.1 |
0.967 |
8 |
9 |
0 |
0.000 |
2 |
2 |
|
D |
67 |
23 |
7568 |
◊ |
A |
x,y,z |
1_555 |
62 |
21 |
7533 |
596.2 |
-5.3 |
0.376 |
2 |
0 |
0 |
0.000 |
3 |
|
C |
65 |
24 |
7457 |
◊ |
B |
x,y,z |
1_555 |
57 |
18 |
7473 |
558.0 |
-5.3 |
0.386 |
2 |
0 |
0 |
0.000 |
Average: |
577.1 |
-5.3 |
0.381 |
2 |
0 |
0 |
0.000 |
3 |
4 |
|
D |
50 |
18 |
7568 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
44 |
16 |
7457 |
462.3 |
-1.8 |
0.605 |
0 |
0 |
0 |
0.000 |
4 |
5 |
|
D |
30 |
12 |
7568 |
◊ |
C |
x,y,z |
1_555 |
34 |
11 |
7457 |
337.2 |
-8.1 |
0.024 |
0 |
0 |
0 |
0.000 |
5 |
6 |
|
B |
32 |
9 |
7473 |
x |
B |
-x,y-1/2,-z |
2_545 |
24 |
9 |
7473 |
250.5 |
-2.9 |
0.324 |
0 |
0 |
0 |
0.000 |
7 |
|
A |
23 |
10 |
7533 |
x |
A |
-x+1,y-1/2,-z |
2_645 |
32 |
8 |
7533 |
249.4 |
-3.5 |
0.248 |
2 |
0 |
0 |
0.000 |
Average: |
250.0 |
-3.2 |
0.286 |
1 |
0 |
0 |
0.000 |
6 |
8 |
|
C |
16 |
6 |
7457 |
◊ |
A |
x,y,z |
1_555 |
23 |
6 |
7533 |
168.8 |
-1.7 |
0.419 |
0 |
0 |
0 |
0.000 |
9 |
|
D |
21 |
6 |
7568 |
◊ |
B |
x,y,z |
1_555 |
20 |
6 |
7473 |
153.3 |
-1.2 |
0.514 |
0 |
0 |
0 |
0.000 |
Average: |
161.1 |
-1.4 |
0.466 |
0 |
0 |
0 |
0.000 |
7 |
10 |
|
[MAN]D:201 |
11 |
1 |
290 |
f |
D |
x,y,z |
1_555 |
23 |
12 |
7568 |
168.2 |
2.9 |
0.451 |
1 |
0 |
0 |
0.000 |
8 |
11 |
|
[MAN]C:201 |
11 |
1 |
290 |
◊ |
C |
x,y,z |
1_555 |
25 |
12 |
7457 |
165.8 |
2.9 |
0.477 |
2 |
0 |
0 |
0.000 |
12 |
|
[MAN]A:201 |
11 |
1 |
288 |
◊ |
A |
x,y,z |
1_555 |
25 |
13 |
7533 |
165.5 |
2.9 |
0.444 |
2 |
0 |
0 |
0.000 |
13 |
|
[MAN]B:201 |
11 |
1 |
289 |
◊ |
B |
x,y,z |
1_555 |
21 |
12 |
7473 |
162.4 |
3.0 |
0.458 |
2 |
0 |
0 |
0.000 |
Average: |
164.6 |
2.9 |
0.460 |
2 |
0 |
0 |
0.000 |
9 |
14 |
|
[MMA]D:202 |
11 |
1 |
326 |
f |
D |
x,y,z |
1_555 |
22 |
10 |
7568 |
155.1 |
2.4 |
0.337 |
0 |
0 |
0 |
0.000 |
10 |
15 |
|
[MMA]A:202 |
12 |
1 |
323 |
◊ |
A |
x,y,z |
1_555 |
19 |
9 |
7533 |
154.2 |
2.1 |
0.248 |
0 |
0 |
0 |
0.000 |
16 |
|
[MMA]B:202 |
12 |
1 |
326 |
◊ |
B |
x,y,z |
1_555 |
19 |
9 |
7473 |
153.6 |
2.2 |
0.265 |
0 |
0 |
0 |
0.000 |
Average: |
153.9 |
2.2 |
0.256 |
0 |
0 |
0 |
0.000 |
11 |
17 |
|
[MMA]C:202 |
12 |
1 |
325 |
◊ |
C |
x,y,z |
1_555 |
19 |
9 |
7457 |
152.7 |
1.9 |
0.295 |
0 |
0 |
0 |
0.000 |
12 |
18 |
|
[MMA]B:202 |
8 |
1 |
326 |
f |
B |
-x,y-1/2,-z |
2_545 |
9 |
4 |
7473 |
78.3 |
1.4 |
0.233 |
0 |
0 |
0 |
0.000 |
19 |
|
A |
9 |
4 |
7533 |
f |
[MMA]A:202 |
-x+1,y-1/2,-z |
2_645 |
8 |
1 |
323 |
75.8 |
1.6 |
0.240 |
0 |
0 |
0 |
0.000 |
Average: |
77.0 |
1.5 |
0.236 |
0 |
0 |
0 |
0.000 |
13 |
20 |
|
[SO4]C:203 |
5 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
9 |
3 |
7457 |
66.8 |
-9.6 |
0.556 |
1 |
0 |
0 |
0.100 |
14 |
21 |
|
[SO4]D:203 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
10 |
3 |
7568 |
60.9 |
-8.5 |
0.637 |
1 |
0 |
0 |
0.586 |
15 |
22 |
|
[MMA]A:202 |
6 |
1 |
323 |
cf |
[MAN]A:201 |
x,y,z |
1_555 |
6 |
1 |
288 |
55.8 |
2.5 |
0.246 |
0 |
0 |
0 |
0.000 |
23 |
|
[MMA]B:202 |
6 |
1 |
326 |
cf |
[MAN]B:201 |
x,y,z |
1_555 |
6 |
1 |
289 |
55.4 |
2.4 |
0.229 |
0 |
0 |
0 |
0.000 |
Average: |
55.6 |
2.4 |
0.237 |
0 |
0 |
0 |
0.000 |
16 |
24 |
|
[MMA]C:202 |
6 |
1 |
325 |
cf |
[MAN]C:201 |
x,y,z |
1_555 |
6 |
1 |
290 |
55.7 |
2.6 |
0.278 |
0 |
0 |
0 |
0.000 |
17 |
25 |
|
[MMA]D:202 |
5 |
1 |
326 |
cf |
[MAN]D:201 |
x,y,z |
1_555 |
5 |
1 |
290 |
53.9 |
2.6 |
0.310 |
0 |
0 |
0 |
0.000 |
|