## |
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 |
|
A |
60 |
19 |
6953 |
◊ |
A |
-x-1,y,-z-1/2 |
4_454 |
61 |
19 |
6953 |
545.8 |
-4.7 |
0.320 |
6 |
0 |
0 |
0.079 |
2 |
2 |
|
B |
55 |
19 |
7077 |
◊ |
B |
-x-1,y,-z-1/2 |
4_454 |
56 |
19 |
7077 |
542.1 |
-1.4 |
0.542 |
8 |
0 |
0 |
0.028 |
3 |
3 |
|
A |
49 |
16 |
6953 |
◊ |
A |
-x,y,-z-1/2 |
4_554 |
49 |
16 |
6953 |
476.8 |
2.4 |
0.797 |
2 |
0 |
0 |
0.000 |
4 |
4 |
|
B |
47 |
16 |
7077 |
◊ |
B |
-x-2,y,-z-1/2 |
4_354 |
47 |
16 |
7077 |
388.1 |
-1.5 |
0.514 |
0 |
0 |
0 |
0.009 |
5 |
5 |
|
B |
43 |
13 |
7077 |
◊ |
A |
-x-1,y,-z-1/2 |
4_454 |
42 |
13 |
6953 |
371.5 |
2.4 |
0.795 |
11 |
0 |
0 |
0.000 |
6 |
6 |
|
B |
26 |
7 |
7077 |
◊ |
A |
x-1/2,y-1/2,z |
5_445 |
27 |
9 |
6953 |
257.0 |
-4.3 |
0.160 |
0 |
0 |
0 |
0.000 |
7 |
7 |
|
A |
24 |
9 |
6953 |
x |
A |
-x-1/2,-y+1/2,z-1/2 |
6_454 |
28 |
10 |
6953 |
240.2 |
2.1 |
0.806 |
4 |
0 |
0 |
0.000 |
8 |
8 |
|
[SIA]X:101 |
18 |
1 |
437 |
◊ |
A |
x,y,z |
1_555 |
31 |
11 |
6953 |
230.9 |
-0.1 |
0.464 |
7 |
0 |
0 |
0.064 |
9 |
|
[SIA]Y:101 |
18 |
1 |
430 |
◊ |
B |
x,y,z |
1_555 |
33 |
13 |
7077 |
230.2 |
0.5 |
0.480 |
7 |
0 |
0 |
0.064 |
Average: |
230.5 |
0.2 |
0.472 |
7 |
0 |
0 |
0.064 |
9 |
10 |
|
X |
21 |
7 |
874 |
◊ |
A |
x,y,z |
1_555 |
23 |
5 |
6953 |
228.5 |
-5.7 |
0.166 |
1 |
0 |
0 |
0.122 |
11 |
|
Y |
20 |
6 |
822 |
◊ |
B |
x,y,z |
1_555 |
24 |
5 |
7077 |
197.5 |
-4.9 |
0.186 |
1 |
0 |
0 |
0.122 |
Average: |
213.0 |
-5.3 |
0.176 |
1 |
0 |
0 |
0.122 |
10 |
12 |
|
B |
20 |
5 |
7077 |
◊ |
A |
-x-1,-y,z-1/2 |
2_454 |
20 |
5 |
6953 |
182.2 |
1.4 |
0.738 |
1 |
0 |
0 |
0.000 |
11 |
13 |
|
[A2G]Y:102 |
11 |
1 |
356 |
cf |
Y |
x,y,z |
1_555 |
14 |
5 |
822 |
108.5 |
2.9 |
0.339 |
1 |
0 |
0 |
0.000 |
14 |
|
[A2G]X:102 |
11 |
1 |
356 |
cf |
X |
x,y,z |
1_555 |
12 |
4 |
874 |
104.8 |
3.0 |
0.350 |
1 |
0 |
0 |
0.000 |
Average: |
106.6 |
3.0 |
0.345 |
1 |
0 |
0 |
0.000 |
12 |
15 |
|
[SO4]B:203 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
17 |
6 |
7077 |
103.7 |
-15.1 |
0.787 |
4 |
0 |
0 |
0.209 |
13 |
16 |
|
[SO4]B:202 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
17 |
10 |
7077 |
101.5 |
-15.5 |
0.875 |
6 |
0 |
0 |
0.225 |
14 |
17 |
|
[SO4]A:203 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
6953 |
100.1 |
-13.9 |
0.875 |
2 |
0 |
0 |
0.317 |
15 |
18 |
|
Y |
9 |
3 |
822 |
◊ |
B |
-x-2,y,-z-1/2 |
4_354 |
12 |
4 |
7077 |
99.1 |
0.3 |
0.777 |
1 |
0 |
0 |
0.001 |
16 |
19 |
|
B |
9 |
5 |
7077 |
◊ |
B |
x,-y,-z-1 |
3_554 |
9 |
5 |
7077 |
97.8 |
-1.6 |
0.257 |
0 |
0 |
0 |
0.000 |
17 |
20 |
|
B |
9 |
3 |
7077 |
◊ |
A |
x,y,z |
1_555 |
9 |
5 |
6953 |
97.3 |
-0.6 |
0.470 |
1 |
0 |
0 |
0.000 |
18 |
21 |
|
A |
13 |
4 |
6953 |
◊ |
X |
-x-1/2,-y+1/2,z-1/2 |
6_454 |
8 |
3 |
874 |
87.3 |
-0.0 |
0.736 |
1 |
0 |
0 |
0.000 |
19 |
22 |
|
[SO4]B:201 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
15 |
5 |
7077 |
83.2 |
-12.4 |
0.751 |
4 |
0 |
0 |
0.175 |
20 |
23 |
|
[SO4]B:204 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
14 |
5 |
7077 |
80.8 |
-12.3 |
0.675 |
4 |
0 |
0 |
0.174 |
21 |
24 |
|
[SO4]A:201 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
15 |
5 |
6953 |
76.9 |
-11.5 |
0.693 |
3 |
0 |
0 |
0.275 |
22 |
25 |
|
[SO4]B:205 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
7077 |
65.5 |
-7.9 |
0.893 |
2 |
0 |
0 |
0.109 |
23 |
26 |
|
[A2G]Y:102 |
9 |
1 |
356 |
◊ |
B |
x,y,z |
1_555 |
9 |
4 |
7077 |
64.5 |
0.9 |
0.096 |
0 |
0 |
0 |
0.000 |
27 |
|
[A2G]X:102 |
9 |
1 |
356 |
◊ |
A |
x,y,z |
1_555 |
8 |
3 |
6953 |
62.7 |
0.7 |
0.100 |
0 |
0 |
0 |
0.000 |
Average: |
63.6 |
0.8 |
0.098 |
0 |
0 |
0 |
0.000 |
24 |
28 |
|
[SO4]A:202 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
5 |
2 |
6953 |
59.6 |
-6.5 |
0.942 |
3 |
0 |
0 |
0.167 |
25 |
29 |
|
[A2G]X:102 |
4 |
1 |
356 |
cf |
[SIA]X:101 |
x,y,z |
1_555 |
8 |
1 |
437 |
57.1 |
2.5 |
0.497 |
0 |
0 |
0 |
0.000 |
30 |
|
[A2G]Y:102 |
4 |
1 |
356 |
cf |
[SIA]Y:101 |
x,y,z |
1_555 |
9 |
1 |
430 |
56.1 |
2.5 |
0.453 |
0 |
0 |
0 |
0.000 |
Average: |
56.6 |
2.5 |
0.475 |
0 |
0 |
0 |
0.000 |
26 |
31 |
|
[SO4]A:201 |
4 |
1 |
186 |
◊ |
A |
-x-1,y,-z-1/2 |
4_454 |
6 |
2 |
6953 |
55.9 |
-7.1 |
0.574 |
1 |
0 |
0 |
0.162 |
27 |
32 |
|
[SIA]X:101 |
7 |
1 |
437 |
f |
X |
x,y,z |
1_555 |
6 |
2 |
874 |
54.2 |
0.2 |
0.545 |
0 |
0 |
0 |
0.000 |
33 |
|
[SIA]Y:101 |
6 |
1 |
430 |
f |
Y |
x,y,z |
1_555 |
5 |
2 |
822 |
41.4 |
0.2 |
0.570 |
0 |
0 |
0 |
0.000 |
Average: |
47.8 |
0.2 |
0.558 |
0 |
0 |
0 |
0.000 |
28 |
34 |
|
[SO4]B:204 |
3 |
1 |
185 |
◊ |
Y |
x,y,z |
1_555 |
8 |
3 |
822 |
51.1 |
-7.0 |
0.890 |
0 |
0 |
0 |
0.086 |
29 |
35 |
|
[A2G]Y:102 |
6 |
1 |
356 |
◊ |
B |
-x-2,y,-z-1/2 |
4_354 |
3 |
1 |
7077 |
50.6 |
1.3 |
0.148 |
3 |
0 |
0 |
0.000 |
30 |
36 |
|
[SO4]A:202 |
2 |
1 |
184 |
◊ |
A |
-x-1/2,-y+1/2,z-1/2 |
6_454 |
7 |
3 |
6953 |
42.3 |
-5.5 |
0.827 |
0 |
0 |
0 |
0.000 |
31 |
37 |
|
[SO4]B:205 |
4 |
1 |
185 |
◊ |
B |
-x-2,y,-z-1/2 |
4_354 |
8 |
2 |
7077 |
40.4 |
-5.2 |
0.767 |
2 |
0 |
0 |
0.073 |
32 |
38 |
|
B |
3 |
1 |
7077 |
◊ |
[SO4]A:203 |
-x-1,-y,z-1/2 |
2_454 |
4 |
1 |
186 |
37.4 |
-2.9 |
0.978 |
1 |
0 |
0 |
0.000 |
33 |
39 |
|
[SIA]X:101 |
4 |
1 |
437 |
◊ |
A |
-x,y,-z-1/2 |
4_554 |
1 |
1 |
6953 |
34.7 |
0.6 |
0.479 |
1 |
0 |
0 |
0.000 |
34 |
40 |
|
Y |
3 |
1 |
822 |
◊ |
X |
x-1/2,y-1/2,z |
5_445 |
2 |
1 |
874 |
34.5 |
-0.1 |
0.692 |
0 |
0 |
0 |
0.000 |
35 |
41 |
|
[SO4]B:201 |
4 |
1 |
186 |
◊ |
B |
-x-1,y,-z-1/2 |
4_454 |
3 |
1 |
7077 |
34.4 |
-4.4 |
0.404 |
0 |
0 |
0 |
0.050 |
36 |
42 |
|
[A2G]Y:102 |
3 |
1 |
356 |
◊ |
[SO4]B:205 |
-x-2,y,-z-1/2 |
4_354 |
4 |
1 |
185 |
31.2 |
-3.9 |
0.311 |
0 |
0 |
0 |
0.039 |
37 |
43 |
|
[SO4]A:201 |
4 |
1 |
186 |
◊ |
X |
-x-1/2,-y+1/2,z-1/2 |
6_454 |
3 |
1 |
874 |
30.1 |
-2.8 |
0.937 |
0 |
0 |
0 |
0.000 |
38 |
44 |
|
A |
4 |
1 |
6953 |
◊ |
X |
x-1/2,-y+1/2,-z |
7_455 |
4 |
1 |
874 |
26.8 |
0.4 |
0.786 |
1 |
0 |
0 |
0.000 |
39 |
45 |
|
[SO4]B:204 |
3 |
1 |
185 |
◊ |
B |
-x-2,y,-z-1/2 |
4_354 |
2 |
1 |
7077 |
18.4 |
-2.5 |
0.499 |
0 |
0 |
0 |
0.030 |
40 |
46 |
|
[SIA]Y:101 |
4 |
1 |
430 |
◊ |
[SO4]B:205 |
-x-2,y,-z-1/2 |
4_354 |
2 |
1 |
185 |
16.7 |
-2.1 |
0.624 |
0 |
0 |
0 |
0.021 |
41 |
47 |
|
[SO4]B:202 |
2 |
1 |
186 |
◊ |
B |
-x-2,y,-z-1/2 |
4_354 |
3 |
1 |
7077 |
14.4 |
-1.7 |
0.825 |
0 |
0 |
0 |
0.020 |
42 |
48 |
|
[SO4]B:205 |
1 |
1 |
185 |
◊ |
Y |
-x-2,y,-z-1/2 |
4_354 |
3 |
1 |
822 |
14.1 |
-1.9 |
0.725 |
0 |
0 |
0 |
0.020 |
43 |
49 |
|
B |
2 |
1 |
7077 |
◊ |
[SIA]X:101 |
x-1/2,y-1/2,z |
5_445 |
2 |
1 |
437 |
8.3 |
-0.2 |
0.366 |
0 |
0 |
0 |
0.000 |
50 |
|
[SIA]Y:101 |
2 |
1 |
430 |
◊ |
A |
x-1/2,y-1/2,z |
5_445 |
2 |
1 |
6953 |
6.8 |
-0.2 |
0.374 |
0 |
0 |
0 |
0.000 |
Average: |
7.6 |
-0.2 |
0.370 |
0 |
0 |
0 |
0.000 |
44 |
51 |
|
[A2G]X:102 |
1 |
1 |
356 |
◊ |
A |
-x,y,-z-1/2 |
4_554 |
1 |
1 |
6953 |
5.9 |
0.3 |
0.250 |
0 |
0 |
0 |
0.000 |
45 |
52 |
|
X |
2 |
1 |
874 |
◊ |
A |
-x,y,-z-1/2 |
4_554 |
1 |
1 |
6953 |
2.2 |
-0.1 |
0.529 |
0 |
0 |
0 |
0.000 |
|