| ## |
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 |
229 |
58 |
16366 |
x |
A |
-y+1,x-y+1,z |
3_665 |
197 |
44 |
16366 |
1911.1 |
-16.3 |
0.260 |
24 |
15 |
0 |
0.547 |
2 |
|
B |
223 |
57 |
16428 |
x |
B |
-y+1,x-y,z |
3_655 |
194 |
43 |
16428 |
1904.9 |
-16.3 |
0.252 |
24 |
15 |
0 |
0.547 |
| Average: |
1908.0 |
-16.3 |
0.256 |
24 |
15 |
0 |
0.547 |
| 2 |
3 |
|
B |
52 |
17 |
16428 |
◊ |
A |
x,y,z |
1_555 |
51 |
14 |
16366 |
447.7 |
-0.8 |
0.643 |
3 |
3 |
0 |
0.000 |
| 3 |
4 |
|
[PUW]B:1341 |
13 |
1 |
390 |
f |
B |
x,y,z |
1_555 |
37 |
20 |
16428 |
244.3 |
-4.1 |
0.716 |
15 |
0 |
0 |
0.218 |
5 |
|
[PUW]A:1341 |
13 |
1 |
387 |
f |
A |
x,y,z |
1_555 |
37 |
20 |
16366 |
243.1 |
-4.2 |
0.713 |
17 |
0 |
0 |
0.218 |
| Average: |
243.7 |
-4.1 |
0.714 |
16 |
0 |
0 |
0.218 |
| 4 |
6 |
|
A |
29 |
12 |
16366 |
◊ |
A |
-x+y,y,-z+1/2 |
10_555 |
29 |
12 |
16366 |
241.1 |
0.0 |
0.682 |
2 |
2 |
0 |
0.000 |
| 5 |
7 |
|
B |
18 |
6 |
16428 |
◊ |
A |
-x+1,-x+y,-z |
9_655 |
19 |
6 |
16366 |
232.1 |
-1.7 |
0.402 |
0 |
0 |
0 |
0.002 |
| 6 |
8 |
|
A |
15 |
6 |
16366 |
◊ |
B |
-y,x-y,z |
3_555 |
27 |
9 |
16428 |
152.8 |
0.3 |
0.628 |
1 |
1 |
0 |
0.000 |
| 7 |
9 |
|
[TRS]B:1342 |
7 |
1 |
256 |
f |
B |
x,y,z |
1_555 |
20 |
9 |
16428 |
134.5 |
2.7 |
0.000 |
2 |
0 |
0 |
0.000 |
| 8 |
10 |
|
[TRS]A:1342 |
7 |
1 |
255 |
f |
A |
x,y,z |
1_555 |
20 |
9 |
16366 |
133.8 |
2.7 |
0.161 |
2 |
0 |
0 |
0.000 |
| 9 |
11 |
|
A |
10 |
3 |
16366 |
◊ |
B |
x-y,-y+1,-z |
7_565 |
10 |
3 |
16428 |
105.7 |
-3.2 |
0.072 |
0 |
0 |
0 |
0.003 |
| 10 |
12 |
|
[SO4]A:1343 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
10 |
3 |
16366 |
92.5 |
-11.1 |
0.890 |
3 |
0 |
0 |
0.232 |
| 11 |
13 |
|
[SO4]B:1343 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
10 |
3 |
16428 |
92.0 |
-11.1 |
0.897 |
3 |
0 |
0 |
0.232 |
| 12 |
14 |
|
[EDO]A:1345 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
16 |
6 |
16428 |
73.0 |
2.2 |
0.261 |
0 |
0 |
0 |
0.000 |
| 13 |
15 |
|
[EDO]A:1344 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
17 |
7 |
16366 |
71.7 |
1.9 |
0.836 |
2 |
0 |
0 |
0.000 |
16 |
|
[EDO]B:1344 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
16 |
6 |
16428 |
71.6 |
1.9 |
0.832 |
2 |
0 |
0 |
0.000 |
| Average: |
71.6 |
1.9 |
0.834 |
2 |
0 |
0 |
0.000 |
| 14 |
17 |
|
[EDO]A:1345 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
16366 |
65.5 |
1.1 |
0.722 |
1 |
0 |
0 |
0.000 |
| 15 |
18 |
|
B |
10 |
4 |
16428 |
◊ |
[EDO]B:1344 |
-y+1,x-y,z |
3_655 |
3 |
1 |
186 |
56.8 |
2.1 |
0.314 |
1 |
0 |
0 |
0.000 |
19 |
|
A |
9 |
4 |
16366 |
◊ |
[EDO]A:1344 |
-y+1,x-y+1,z |
3_665 |
4 |
1 |
184 |
55.7 |
2.1 |
0.897 |
1 |
0 |
0 |
0.000 |
| Average: |
56.2 |
2.1 |
0.606 |
1 |
0 |
0 |
0.000 |
| 16 |
20 |
|
[NI]A:1346 |
1 |
1 |
115 |
x |
A |
x,y,z |
1_555 |
6 |
3 |
16366 |
44.5 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.097 |
21 |
|
[NI]B:1345 |
1 |
1 |
115 |
x |
B |
x,y,z |
1_555 |
6 |
3 |
16428 |
44.1 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.097 |
| Average: |
44.3 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.097 |
| 17 |
22 |
|
[PUW]B:1341 |
6 |
1 |
390 |
◊ |
B |
-y+1,x-y,z |
3_655 |
3 |
2 |
16428 |
36.8 |
-1.6 |
0.700 |
1 |
0 |
0 |
0.040 |
23 |
|
[PUW]A:1341 |
6 |
1 |
387 |
◊ |
A |
-y+1,x-y+1,z |
3_665 |
4 |
2 |
16366 |
36.8 |
-1.7 |
0.691 |
1 |
0 |
0 |
0.040 |
| Average: |
36.8 |
-1.7 |
0.696 |
1 |
0 |
0 |
0.040 |
| 18 |
24 |
|
B |
7 |
1 |
16428 |
◊ |
[SO4]B:1343 |
-y+1,x-y,z |
3_655 |
4 |
1 |
186 |
36.3 |
-5.1 |
0.541 |
0 |
0 |
0 |
0.095 |
| 19 |
25 |
|
A |
7 |
1 |
16366 |
◊ |
[SO4]A:1343 |
-y+1,x-y+1,z |
3_665 |
4 |
1 |
186 |
35.7 |
-4.9 |
0.546 |
0 |
0 |
0 |
0.092 |
| 20 |
26 |
|
[EDO]B:1344 |
4 |
1 |
186 |
x |
[EDO]B:1344 |
-y+1,x-y,z |
3_655 |
3 |
1 |
186 |
32.2 |
1.7 |
1.000 |
0 |
0 |
0 |
0.000 |
27 |
|
[EDO]A:1344 |
4 |
1 |
184 |
x |
[EDO]A:1344 |
-y+1,x-y+1,z |
3_665 |
3 |
1 |
184 |
31.1 |
1.6 |
1.000 |
0 |
0 |
0 |
0.000 |
| Average: |
31.7 |
1.7 |
1.000 |
0 |
0 |
0 |
0.000 |
|