## |
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 |
92 |
30 |
9679 |
◊ |
A |
x,y,z |
1_555 |
92 |
31 |
9681 |
921.8 |
-14.2 |
0.038 |
8 |
0 |
0 |
0.213 |
2 |
|
C |
96 |
30 |
9698 |
◊ |
B |
x,y,z |
1_555 |
96 |
30 |
9773 |
918.5 |
-13.9 |
0.051 |
9 |
0 |
0 |
0.213 |
Average: |
920.2 |
-14.1 |
0.045 |
9 |
0 |
0 |
0.213 |
2 |
3 |
|
B |
71 |
23 |
9773 |
◊ |
A |
x,y,z |
1_555 |
73 |
25 |
9681 |
626.4 |
-6.0 |
0.327 |
3 |
0 |
0 |
0.091 |
3 |
4 |
|
D |
53 |
18 |
9679 |
◊ |
C |
x,y,z |
1_555 |
50 |
18 |
9698 |
527.6 |
3.5 |
0.923 |
8 |
7 |
0 |
0.006 |
4 |
5 |
|
D |
46 |
16 |
9679 |
◊ |
C |
x,y,z-1 |
1_554 |
49 |
16 |
9698 |
415.0 |
-1.3 |
0.613 |
2 |
0 |
0 |
0.000 |
5 |
6 |
|
B |
44 |
14 |
9773 |
◊ |
D |
-x+3/2,y-1/2,-z+1 |
3_646 |
52 |
20 |
9679 |
400.3 |
-1.7 |
0.592 |
4 |
0 |
0 |
0.000 |
6 |
7 |
|
B |
29 |
9 |
9773 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
30 |
9 |
9681 |
312.3 |
-3.5 |
0.265 |
2 |
0 |
0 |
0.000 |
7 |
8 |
|
[GAL]C:239 |
11 |
1 |
296 |
f |
C |
x,y,z |
1_555 |
23 |
11 |
9698 |
161.4 |
3.0 |
0.409 |
6 |
0 |
0 |
0.000 |
9 |
|
[GAL]A:239 |
11 |
1 |
293 |
f |
A |
x,y,z |
1_555 |
24 |
12 |
9681 |
161.3 |
2.9 |
0.376 |
6 |
0 |
0 |
0.000 |
10 |
|
[GAL]B:239 |
11 |
1 |
293 |
f |
B |
x,y,z |
1_555 |
25 |
11 |
9773 |
159.5 |
2.9 |
0.375 |
5 |
0 |
0 |
0.000 |
11 |
|
[GAL]D:239 |
11 |
1 |
292 |
f |
D |
x,y,z |
1_555 |
24 |
11 |
9679 |
159.0 |
3.1 |
0.387 |
6 |
0 |
0 |
0.000 |
Average: |
160.3 |
3.0 |
0.387 |
6 |
0 |
0 |
0.000 |
8 |
12 |
|
[SO4]C:3241 |
5 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
12 |
7 |
9698 |
104.9 |
-16.3 |
0.756 |
4 |
0 |
0 |
0.215 |
9 |
13 |
|
[SO4]B:2241 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
13 |
7 |
9773 |
103.1 |
-15.9 |
0.775 |
4 |
0 |
0 |
0.219 |
10 |
14 |
|
[SO4]A:1241 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
14 |
8 |
9681 |
102.1 |
-15.8 |
0.768 |
4 |
0 |
0 |
0.219 |
11 |
15 |
|
[SO4]D:4241 |
5 |
1 |
187 |
f |
D |
x,y,z |
1_555 |
11 |
6 |
9679 |
92.8 |
-15.1 |
0.740 |
4 |
0 |
0 |
0.200 |
12 |
16 |
|
[GAL]C:240 |
6 |
1 |
301 |
cf |
[GAL]C:239 |
x,y,z |
1_555 |
7 |
1 |
296 |
71.4 |
2.0 |
0.149 |
1 |
0 |
0 |
0.000 |
13 |
17 |
|
[GAL]D:240 |
6 |
1 |
299 |
cf |
[GAL]D:239 |
x,y,z |
1_555 |
6 |
1 |
292 |
69.1 |
2.0 |
0.128 |
1 |
0 |
0 |
0.000 |
14 |
18 |
|
A |
5 |
2 |
9681 |
◊ |
C |
-x+3/2,y-1/2,-z+1 |
3_646 |
9 |
2 |
9698 |
66.9 |
-1.5 |
0.173 |
0 |
0 |
0 |
0.000 |
15 |
19 |
|
[GAL]B:240 |
7 |
1 |
300 |
cf |
[GAL]B:239 |
x,y,z |
1_555 |
6 |
1 |
293 |
63.1 |
2.7 |
0.204 |
0 |
0 |
0 |
0.000 |
20 |
|
[GAL]A:240 |
7 |
1 |
299 |
cf |
[GAL]A:239 |
x,y,z |
1_555 |
6 |
1 |
293 |
61.6 |
2.7 |
0.182 |
0 |
0 |
0 |
0.000 |
Average: |
62.4 |
2.7 |
0.193 |
0 |
0 |
0 |
0.000 |
16 |
21 |
|
D |
11 |
4 |
9679 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
9773 |
61.0 |
0.6 |
0.760 |
2 |
0 |
0 |
0.003 |
22 |
|
C |
9 |
4 |
9698 |
◊ |
A |
x,y,z |
1_555 |
7 |
2 |
9681 |
58.9 |
0.6 |
0.748 |
2 |
0 |
0 |
0.003 |
Average: |
59.9 |
0.6 |
0.754 |
2 |
0 |
0 |
0.003 |
17 |
23 |
|
[GAL]C:240 |
6 |
1 |
301 |
f |
C |
x,y,z |
1_555 |
11 |
5 |
9698 |
60.5 |
1.0 |
0.318 |
0 |
0 |
0 |
0.000 |
18 |
24 |
|
[GAL]B:240 |
6 |
1 |
300 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
9773 |
59.6 |
1.2 |
0.374 |
1 |
0 |
0 |
0.000 |
25 |
|
[GAL]A:240 |
6 |
1 |
299 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
9681 |
55.2 |
1.0 |
0.344 |
1 |
0 |
0 |
0.000 |
Average: |
57.4 |
1.1 |
0.359 |
1 |
0 |
0 |
0.000 |
19 |
26 |
|
[MN]D:238 |
1 |
1 |
123 |
f |
D |
x,y,z |
1_555 |
10 |
7 |
9679 |
58.9 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.143 |
27 |
|
[MN]B:238 |
1 |
1 |
123 |
f |
B |
x,y,z |
1_555 |
9 |
6 |
9773 |
57.9 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.143 |
28 |
|
[MN]A:238 |
1 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
9 |
6 |
9681 |
57.9 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.143 |
29 |
|
[MN]C:238 |
1 |
1 |
123 |
f |
C |
x,y,z |
1_555 |
7 |
4 |
9698 |
57.2 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.143 |
Average: |
58.0 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.143 |
20 |
30 |
|
[GAL]D:240 |
6 |
1 |
299 |
f |
D |
x,y,z |
1_555 |
11 |
5 |
9679 |
52.6 |
1.2 |
0.352 |
0 |
0 |
0 |
0.000 |
21 |
31 |
|
[CA]D:237 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
13 |
7 |
9679 |
42.4 |
-10.9 |
0.000 |
0 |
0 |
0 |
0.267 |
32 |
|
[CA]B:237 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
10 |
6 |
9773 |
41.7 |
-10.8 |
0.000 |
0 |
0 |
0 |
0.267 |
33 |
|
[CA]C:237 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
10 |
6 |
9698 |
41.6 |
-10.8 |
0.000 |
0 |
0 |
0 |
0.267 |
34 |
|
[CA]A:237 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
11 |
7 |
9681 |
41.5 |
-10.7 |
0.000 |
0 |
0 |
0 |
0.267 |
Average: |
41.8 |
-10.8 |
0.000 |
0 |
0 |
0 |
0.267 |
22 |
35 |
|
[SO4]A:1241 |
4 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
9773 |
33.8 |
-4.9 |
0.600 |
0 |
0 |
0 |
0.061 |
23 |
36 |
|
[SO4]B:2241 |
1 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
9681 |
23.3 |
-3.3 |
0.482 |
0 |
0 |
0 |
0.041 |
24 |
37 |
|
[MN]C:238 |
1 |
1 |
123 |
f |
[CA]C:237 |
x,y,z |
1_555 |
1 |
1 |
85 |
12.9 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.031 |
25 |
38 |
|
[MN]A:238 |
1 |
1 |
123 |
f |
[CA]A:237 |
x,y,z |
1_555 |
1 |
1 |
85 |
12.9 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.032 |
26 |
39 |
|
[MN]B:238 |
1 |
1 |
123 |
f |
[CA]B:237 |
x,y,z |
1_555 |
1 |
1 |
85 |
12.7 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.032 |
27 |
40 |
|
[MN]D:238 |
1 |
1 |
123 |
f |
[CA]D:237 |
x,y,z |
1_555 |
1 |
1 |
85 |
12.0 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.028 |
28 |
41 |
|
A |
2 |
2 |
9681 |
◊ |
D |
-x+3/2,y-1/2,-z+1 |
3_646 |
2 |
1 |
9679 |
5.2 |
0.1 |
0.694 |
0 |
0 |
0 |
0.000 |
29 |
42 |
|
D |
1 |
1 |
9679 |
◊ |
B |
-x+1,-y+1,z |
2_665 |
1 |
1 |
9773 |
0.3 |
0.0 |
0.694 |
0 |
0 |
0 |
0.000 |
|