| ## |
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 |
|
F |
217 |
30 |
13203 |
◊ |
D |
x,y,z |
1_555 |
210 |
68 |
40750 |
1886.5 |
-38.7 |
0.458 |
24 |
0 |
0 |
0.313 |
2 |
|
B |
215 |
30 |
13174 |
◊ |
A |
x,y,z |
1_555 |
218 |
70 |
39948 |
1863.5 |
-37.3 |
0.416 |
19 |
0 |
0 |
0.313 |
| Average: |
1875.0 |
-38.0 |
0.437 |
22 |
0 |
0 |
0.313 |
| 2 |
3 |
|
A |
132 |
39 |
39948 |
◊ |
A |
-x-1,y,-z-1 |
2_454 |
132 |
39 |
39948 |
1180.1 |
-13.8 |
0.061 |
0 |
0 |
0 |
0.002 |
| 3 |
4 |
|
A |
81 |
27 |
39948 |
◊ |
D |
x,y-1,z |
1_545 |
71 |
27 |
40750 |
726.4 |
-2.7 |
0.436 |
8 |
0 |
0 |
0.000 |
| 4 |
5 |
|
F |
81 |
15 |
13203 |
◊ |
B |
x,y,z |
1_555 |
79 |
15 |
13174 |
652.6 |
-14.5 |
0.935 |
6 |
0 |
0 |
1.000 |
| 5 |
6 |
|
D |
55 |
18 |
40750 |
x |
D |
-x-1/2,y-1/2,-z |
4_445 |
65 |
22 |
40750 |
514.2 |
-3.4 |
0.352 |
3 |
1 |
0 |
0.000 |
7 |
|
A |
66 |
23 |
39948 |
x |
A |
-x-1/2,y-1/2,-z-1 |
4_444 |
44 |
15 |
39948 |
478.1 |
-3.6 |
0.252 |
5 |
2 |
0 |
0.000 |
| Average: |
496.2 |
-3.5 |
0.302 |
4 |
2 |
0 |
0.000 |
| 6 |
8 |
|
[ANZ]F:76 |
31 |
1 |
643 |
◊ |
D |
x,y,z |
1_555 |
60 |
21 |
40750 |
433.2 |
1.4 |
0.579 |
9 |
0 |
0 |
0.017 |
9 |
|
[ANZ]B:76 |
29 |
1 |
636 |
◊ |
A |
x,y,z |
1_555 |
61 |
22 |
39948 |
433.2 |
1.3 |
0.571 |
9 |
0 |
0 |
0.017 |
| Average: |
433.2 |
1.3 |
0.575 |
9 |
0 |
0 |
0.017 |
| 7 |
10 |
|
D |
15 |
6 |
40750 |
◊ |
A |
-x-1,y,-z-1 |
2_454 |
18 |
7 |
39948 |
159.1 |
-0.6 |
0.481 |
2 |
0 |
0 |
0.000 |
| 8 |
11 |
|
[SO4]A:1886 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
21 |
11 |
39948 |
120.8 |
-17.0 |
0.745 |
4 |
0 |
0 |
0.117 |
| 9 |
12 |
|
[SO4]D:1879 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
17 |
9 |
40750 |
117.8 |
-16.1 |
0.769 |
5 |
0 |
0 |
0.116 |
| 10 |
13 |
|
[SO4]A:1882 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
16 |
9 |
39948 |
105.0 |
-15.7 |
0.545 |
4 |
0 |
0 |
0.109 |
| 11 |
14 |
|
[SO4]A:1881 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
19 |
7 |
39948 |
102.7 |
-15.0 |
0.772 |
2 |
0 |
0 |
0.099 |
| 12 |
15 |
|
[ANZ]F:76 |
13 |
1 |
643 |
cf |
F |
x,y,z |
1_555 |
11 |
2 |
13203 |
100.3 |
1.2 |
0.731 |
0 |
0 |
0 |
0.000 |
16 |
|
[ANZ]B:76 |
14 |
1 |
636 |
cf |
B |
x,y,z |
1_555 |
11 |
2 |
13174 |
97.7 |
1.7 |
0.748 |
0 |
0 |
0 |
0.000 |
| Average: |
99.0 |
1.4 |
0.740 |
0 |
0 |
0 |
0.000 |
| 13 |
17 |
|
[SO4]D:1877 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
16 |
7 |
40750 |
100.2 |
-15.5 |
0.811 |
6 |
0 |
0 |
0.115 |
| 14 |
18 |
|
[SO4]A:1885 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
16 |
3 |
39948 |
94.3 |
-13.5 |
0.786 |
1 |
0 |
0 |
0.087 |
| 15 |
19 |
|
[HG]A:1879 |
1 |
1 |
137 |
f |
A |
x,y,z |
1_555 |
11 |
7 |
39948 |
73.9 |
-25.1 |
0.000 |
0 |
0 |
0 |
0.160 |
20 |
|
[HG]D:1882 |
1 |
1 |
137 |
f |
D |
x,y,z |
1_555 |
12 |
6 |
40750 |
73.2 |
-25.2 |
0.000 |
0 |
0 |
0 |
0.160 |
| Average: |
73.6 |
-25.2 |
0.000 |
0 |
0 |
0 |
0.160 |
| 16 |
21 |
|
[SO4]A:1884 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
39948 |
67.4 |
-8.5 |
0.832 |
3 |
0 |
0 |
0.061 |
| 17 |
22 |
|
[SO4]A:1883 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
9 |
3 |
39948 |
59.1 |
-7.2 |
0.847 |
3 |
0 |
0 |
0.053 |
23 |
|
[SO4]D:1878 |
4 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
10 |
5 |
40750 |
57.8 |
-6.5 |
0.898 |
2 |
0 |
0 |
0.053 |
| Average: |
58.5 |
-6.8 |
0.873 |
3 |
0 |
0 |
0.053 |
| 18 |
24 |
|
[ZN]D:1880 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
8 |
7 |
40750 |
55.7 |
-37.8 |
0.000 |
0 |
0 |
0 |
0.240 |
| 19 |
25 |
|
[SO4]A:1880 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
5 |
4 |
39948 |
45.8 |
-4.3 |
0.938 |
0 |
0 |
0 |
0.027 |
| 20 |
26 |
|
F |
6 |
3 |
13203 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
39948 |
38.0 |
-0.7 |
0.578 |
1 |
0 |
0 |
0.005 |
27 |
|
B |
6 |
2 |
13174 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
40750 |
28.8 |
-0.4 |
0.691 |
0 |
0 |
0 |
0.005 |
| Average: |
33.4 |
-0.6 |
0.635 |
1 |
0 |
0 |
0.005 |
|