| ## |
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 |
|
C |
94 |
30 |
9692 |
◊ |
B |
x,y,z |
1_555 |
94 |
30 |
9789 |
931.2 |
-13.7 |
0.054 |
8 |
0 |
0 |
0.334 |
2 |
|
D |
93 |
30 |
9691 |
◊ |
A |
x,y,z |
1_555 |
90 |
31 |
9737 |
927.2 |
-14.0 |
0.035 |
8 |
0 |
0 |
0.334 |
| Average: |
929.2 |
-13.8 |
0.045 |
8 |
0 |
0 |
0.334 |
| 2 |
3 |
|
B |
69 |
24 |
9789 |
◊ |
A |
x,y,z |
1_555 |
69 |
23 |
9737 |
599.6 |
-4.7 |
0.408 |
4 |
0 |
0 |
0.043 |
| 3 |
4 |
|
D |
49 |
18 |
9691 |
◊ |
C |
x,y,z |
1_555 |
53 |
19 |
9692 |
531.8 |
3.1 |
0.915 |
10 |
6 |
0 |
0.015 |
| 4 |
5 |
|
B |
46 |
14 |
9789 |
◊ |
D |
-x+3/2,y-1/2,-z+1 |
3_646 |
47 |
17 |
9691 |
402.1 |
-1.2 |
0.632 |
4 |
0 |
0 |
0.000 |
| 5 |
6 |
|
D |
41 |
16 |
9691 |
◊ |
C |
x,y,z-1 |
1_554 |
50 |
15 |
9692 |
392.4 |
-0.4 |
0.682 |
4 |
0 |
0 |
0.000 |
| 6 |
7 |
|
B |
30 |
9 |
9789 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
31 |
10 |
9737 |
311.4 |
-3.5 |
0.262 |
2 |
0 |
0 |
0.003 |
| 7 |
8 |
|
[GAL]C:239 |
11 |
1 |
301 |
f |
C |
x,y,z |
1_555 |
25 |
11 |
9692 |
157.2 |
2.7 |
0.353 |
5 |
0 |
0 |
0.000 |
9 |
|
[GAL]B:239 |
11 |
1 |
300 |
f |
B |
x,y,z |
1_555 |
24 |
11 |
9789 |
156.2 |
3.0 |
0.382 |
6 |
0 |
0 |
0.000 |
10 |
|
[GAL]A:239 |
11 |
1 |
300 |
f |
A |
x,y,z |
1_555 |
25 |
12 |
9737 |
156.1 |
2.8 |
0.379 |
6 |
0 |
0 |
0.000 |
11 |
|
[GAL]D:239 |
11 |
1 |
299 |
f |
D |
x,y,z |
1_555 |
25 |
12 |
9691 |
155.8 |
2.9 |
0.384 |
5 |
0 |
0 |
0.000 |
| Average: |
156.3 |
2.9 |
0.375 |
6 |
0 |
0 |
0.000 |
| 8 |
12 |
|
[MGC]C:240 |
11 |
1 |
408 |
f |
C |
x,y,z |
1_555 |
17 |
7 |
9692 |
123.0 |
-0.0 |
0.248 |
3 |
0 |
0 |
0.054 |
13 |
|
[MGC]B:240 |
10 |
1 |
407 |
f |
B |
x,y,z |
1_555 |
16 |
7 |
9789 |
120.1 |
0.3 |
0.267 |
3 |
0 |
0 |
0.054 |
14 |
|
[MGC]A:240 |
10 |
1 |
408 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
9737 |
119.8 |
0.3 |
0.265 |
3 |
0 |
0 |
0.054 |
15 |
|
[MGC]D:240 |
11 |
1 |
406 |
f |
D |
x,y,z |
1_555 |
17 |
7 |
9691 |
119.7 |
-0.0 |
0.232 |
4 |
0 |
0 |
0.054 |
| Average: |
120.6 |
0.1 |
0.253 |
3 |
0 |
0 |
0.054 |
| 9 |
16 |
|
[SO4]B:2236 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
14 |
7 |
9789 |
103.3 |
-16.5 |
0.757 |
3 |
0 |
0 |
0.207 |
| 10 |
17 |
|
[SO4]C:1236 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
13 |
6 |
9692 |
96.5 |
-15.1 |
0.754 |
3 |
0 |
0 |
0.192 |
| 11 |
18 |
|
A |
5 |
2 |
9737 |
◊ |
C |
-x+3/2,y-1/2,-z+1 |
3_646 |
9 |
2 |
9692 |
72.0 |
-1.6 |
0.132 |
0 |
0 |
0 |
0.000 |
| 12 |
19 |
|
[MGC]C:240 |
9 |
1 |
408 |
cf |
[GAL]C:239 |
x,y,z |
1_555 |
6 |
1 |
301 |
68.9 |
2.3 |
0.226 |
0 |
0 |
0 |
0.000 |
20 |
|
[MGC]A:240 |
7 |
1 |
408 |
cf |
[GAL]A:239 |
x,y,z |
1_555 |
7 |
1 |
300 |
67.2 |
2.3 |
0.219 |
0 |
0 |
0 |
0.000 |
21 |
|
[MGC]D:240 |
9 |
1 |
406 |
cf |
[GAL]D:239 |
x,y,z |
1_555 |
7 |
1 |
299 |
67.2 |
2.3 |
0.195 |
0 |
0 |
0 |
0.000 |
22 |
|
[MGC]B:240 |
7 |
1 |
407 |
cf |
[GAL]B:239 |
x,y,z |
1_555 |
6 |
1 |
300 |
66.2 |
2.2 |
0.231 |
0 |
0 |
0 |
0.000 |
| Average: |
67.4 |
2.3 |
0.218 |
0 |
0 |
0 |
0.000 |
| 13 |
23 |
|
D |
11 |
4 |
9691 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
9789 |
61.0 |
0.6 |
0.761 |
2 |
0 |
0 |
0.004 |
24 |
|
C |
11 |
4 |
9692 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
9737 |
59.2 |
0.5 |
0.741 |
2 |
0 |
0 |
0.004 |
| Average: |
60.1 |
0.6 |
0.751 |
2 |
0 |
0 |
0.004 |
| 14 |
25 |
|
[MN]B:238 |
1 |
1 |
123 |
f |
B |
x,y,z |
1_555 |
7 |
4 |
9789 |
58.1 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.211 |
26 |
|
[MN]A:238 |
1 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
9737 |
58.1 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.211 |
27 |
|
[MN]D:238 |
1 |
1 |
123 |
f |
D |
x,y,z |
1_555 |
9 |
7 |
9691 |
58.0 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.211 |
28 |
|
[MN]C:238 |
1 |
1 |
123 |
f |
C |
x,y,z |
1_555 |
9 |
6 |
9692 |
57.9 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.211 |
| Average: |
58.0 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.211 |
| 15 |
29 |
|
[CA]C:237 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
11 |
7 |
9692 |
43.9 |
-10.8 |
0.000 |
0 |
0 |
0 |
0.412 |
30 |
|
[CA]B:237 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
9789 |
43.8 |
-11.0 |
0.000 |
0 |
0 |
0 |
0.412 |
31 |
|
[CA]D:237 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
11 |
7 |
9691 |
42.3 |
-10.8 |
0.000 |
0 |
0 |
0 |
0.412 |
32 |
|
[CA]A:237 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
11 |
7 |
9737 |
41.9 |
-10.9 |
0.000 |
0 |
0 |
0 |
0.412 |
| Average: |
43.0 |
-10.9 |
0.000 |
0 |
0 |
0 |
0.412 |
| 16 |
33 |
|
[MGC]B:240 |
2 |
1 |
407 |
◊ |
[MGC]A:240 |
x-1/2,-y+1/2,-z+1 |
4_456 |
2 |
1 |
408 |
33.8 |
1.3 |
0.555 |
1 |
0 |
0 |
0.000 |
| 17 |
34 |
|
[SO4]B:2236 |
1 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
9737 |
24.9 |
-3.3 |
0.655 |
0 |
0 |
0 |
0.022 |
| 18 |
35 |
|
B |
2 |
2 |
9789 |
◊ |
[MGC]A:240 |
x-1/2,-y+1/2,-z+1 |
4_456 |
2 |
1 |
408 |
20.9 |
0.2 |
0.283 |
0 |
0 |
0 |
0.000 |
36 |
|
[MGC]B:240 |
2 |
1 |
407 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
2 |
2 |
9737 |
20.7 |
0.2 |
0.287 |
0 |
0 |
0 |
0.000 |
| Average: |
20.8 |
0.2 |
0.285 |
0 |
0 |
0 |
0.000 |
| 19 |
37 |
|
[MN]A:238 |
1 |
1 |
123 |
f |
[CA]A:237 |
x,y,z |
1_555 |
1 |
1 |
85 |
12.3 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.047 |
| 20 |
38 |
|
[MN]C:238 |
1 |
1 |
123 |
f |
[CA]C:237 |
x,y,z |
1_555 |
1 |
1 |
85 |
12.3 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.029 |
| 21 |
39 |
|
[MN]D:238 |
1 |
1 |
123 |
f |
[CA]D:237 |
x,y,z |
1_555 |
1 |
1 |
85 |
12.2 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.047 |
| 22 |
40 |
|
[MN]B:238 |
1 |
1 |
123 |
f |
[CA]B:237 |
x,y,z |
1_555 |
1 |
1 |
85 |
11.4 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.027 |
| 23 |
41 |
|
D |
2 |
1 |
9691 |
◊ |
B |
-x+1,-y+1,z |
2_665 |
3 |
1 |
9789 |
9.2 |
0.1 |
0.615 |
0 |
0 |
0 |
0.000 |
| 24 |
42 |
|
A |
2 |
2 |
9737 |
◊ |
D |
-x+3/2,y-1/2,-z+1 |
3_646 |
2 |
1 |
9691 |
5.5 |
0.1 |
0.660 |
0 |
0 |
0 |
0.000 |
|