| ## |
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 |
|
B |
148 |
40 |
8352 |
◊ |
A |
x,y,z |
1_555 |
150 |
39 |
8488 |
1354.7 |
-12.8 |
0.413 |
22 |
2 |
0 |
0.208 |
| 2 |
2 |
|
A |
47 |
10 |
8488 |
x |
A |
-y+1,x-y+1,z+1/3 |
2_665 |
51 |
17 |
8488 |
415.7 |
-4.9 |
0.429 |
4 |
2 |
0 |
0.000 |
3 |
|
B |
50 |
17 |
8352 |
x |
B |
-y,x-y+1,z+1/3 |
2_565 |
44 |
10 |
8352 |
360.3 |
-5.3 |
0.354 |
3 |
0 |
0 |
0.000 |
| Average: |
388.0 |
-5.1 |
0.392 |
4 |
1 |
0 |
0.000 |
| 3 |
4 |
|
B |
26 |
10 |
8352 |
◊ |
A |
-y,x-y+1,z+1/3 |
2_565 |
24 |
7 |
8488 |
247.3 |
-3.7 |
0.275 |
1 |
0 |
0 |
0.000 |
5 |
|
B |
27 |
8 |
8352 |
◊ |
A |
-y+1,x-y+1,z+1/3 |
2_665 |
25 |
10 |
8488 |
242.8 |
-3.6 |
0.286 |
1 |
0 |
0 |
0.000 |
| Average: |
245.0 |
-3.6 |
0.280 |
1 |
0 |
0 |
0.000 |
| 4 |
6 |
|
[C5Q]A:1218 |
22 |
1 |
452 |
f |
A |
x,y,z |
1_555 |
31 |
10 |
8488 |
216.8 |
-0.2 |
0.261 |
0 |
0 |
0 |
0.003 |
7 |
|
[C5Q]B:1214 |
21 |
1 |
453 |
f |
B |
x,y,z |
1_555 |
31 |
10 |
8352 |
215.9 |
-0.2 |
0.244 |
0 |
0 |
0 |
0.003 |
| Average: |
216.4 |
-0.2 |
0.253 |
0 |
0 |
0 |
0.003 |
| 5 |
8 |
|
[C5Q]B:1215 |
18 |
1 |
445 |
◊ |
A |
x,y,z |
1_555 |
30 |
11 |
8488 |
189.7 |
1.1 |
0.424 |
0 |
0 |
0 |
0.000 |
| 6 |
9 |
|
[C5Q]A:1217 |
16 |
1 |
453 |
f |
A |
x,y,z |
1_555 |
29 |
10 |
8488 |
189.2 |
-1.0 |
0.259 |
1 |
0 |
0 |
0.013 |
| 7 |
10 |
|
[C5Q]B:1215 |
15 |
1 |
445 |
f |
B |
x,y,z |
1_555 |
30 |
10 |
8352 |
174.6 |
-0.6 |
0.265 |
2 |
0 |
0 |
0.014 |
| 8 |
11 |
|
[C5Q]A:1217 |
17 |
1 |
453 |
◊ |
B |
x,y,z |
1_555 |
23 |
8 |
8352 |
170.0 |
-0.5 |
0.290 |
0 |
0 |
0 |
0.004 |
| 9 |
12 |
|
A |
9 |
3 |
8488 |
◊ |
B |
-y+1,x-y+1,z-2/3 |
2_664 |
13 |
4 |
8352 |
105.3 |
-1.3 |
0.382 |
0 |
0 |
0 |
0.000 |
13 |
|
A |
13 |
4 |
8488 |
◊ |
B |
-y,x-y+1,z-2/3 |
2_564 |
11 |
4 |
8352 |
102.0 |
-1.4 |
0.405 |
0 |
0 |
0 |
0.000 |
| Average: |
103.7 |
-1.3 |
0.394 |
0 |
0 |
0 |
0.000 |
| 10 |
14 |
|
[C5Q]A:1218 |
16 |
1 |
452 |
◊ |
B |
x,y,z |
1_555 |
11 |
4 |
8352 |
104.8 |
0.7 |
0.324 |
1 |
0 |
0 |
0.000 |
15 |
|
[C5Q]B:1214 |
16 |
1 |
453 |
◊ |
A |
x,y,z |
1_555 |
11 |
4 |
8488 |
104.4 |
0.8 |
0.303 |
1 |
0 |
0 |
0.000 |
| Average: |
104.6 |
0.7 |
0.313 |
1 |
0 |
0 |
0.000 |
| 11 |
16 |
|
[EDO]A:1216 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
18 |
7 |
8488 |
103.2 |
3.4 |
0.529 |
1 |
0 |
0 |
0.000 |
| 12 |
17 |
|
[SO4]A:1212 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
8488 |
98.9 |
-14.4 |
0.814 |
2 |
0 |
0 |
0.139 |
| 13 |
18 |
|
[SO4]B:1211 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
14 |
7 |
8352 |
98.9 |
-13.3 |
0.906 |
3 |
0 |
0 |
0.133 |
| 14 |
19 |
|
[SO4]B:1212 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
8352 |
81.9 |
-12.7 |
0.824 |
7 |
0 |
0 |
0.144 |
| 15 |
20 |
|
[SO4]A:1211 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
8488 |
81.3 |
-12.6 |
0.826 |
7 |
0 |
0 |
0.143 |
| 16 |
21 |
|
[SO4]A:1210 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
8488 |
80.4 |
-11.4 |
0.895 |
5 |
0 |
0 |
0.124 |
| 17 |
22 |
|
[SO4]B:1210 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
8352 |
80.0 |
-11.4 |
0.896 |
5 |
0 |
0 |
0.124 |
| 18 |
23 |
|
[C5Q]A:1218 |
5 |
1 |
452 |
◊ |
A |
-y+1,x-y+1,z+1/3 |
2_665 |
8 |
3 |
8488 |
65.7 |
1.5 |
0.498 |
0 |
0 |
0 |
0.000 |
24 |
|
B |
8 |
3 |
8352 |
◊ |
[C5Q]B:1214 |
-y,x-y+1,z+1/3 |
2_565 |
4 |
1 |
453 |
64.7 |
1.5 |
0.517 |
0 |
0 |
0 |
0.000 |
| Average: |
65.2 |
1.5 |
0.507 |
0 |
0 |
0 |
0.000 |
| 19 |
25 |
|
[SO4]B:1210 |
4 |
1 |
186 |
◊ |
B |
-y,x-y+1,z+1/3 |
2_565 |
5 |
2 |
8352 |
47.6 |
-6.1 |
0.813 |
1 |
0 |
0 |
0.000 |
| 20 |
26 |
|
[EDO]A:1216 |
3 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
4 |
2 |
8352 |
31.1 |
1.3 |
0.962 |
1 |
0 |
0 |
0.000 |
| 21 |
27 |
|
A |
3 |
1 |
8488 |
◊ |
[SO4]A:1210 |
-y+1,x-y+1,z+1/3 |
2_665 |
3 |
1 |
187 |
27.4 |
-3.6 |
0.610 |
0 |
0 |
0 |
0.000 |
| 22 |
28 |
|
[SO4]B:1212 |
1 |
1 |
186 |
◊ |
A |
-y,x-y+1,z+1/3 |
2_565 |
2 |
1 |
8488 |
7.5 |
-1.0 |
0.604 |
0 |
0 |
0 |
0.000 |
| 23 |
29 |
|
B |
2 |
1 |
8352 |
◊ |
[SO4]A:1211 |
-y+1,x-y+1,z+1/3 |
2_665 |
1 |
1 |
185 |
7.2 |
-1.0 |
0.606 |
0 |
0 |
0 |
0.000 |
| 24 |
30 |
|
B |
1 |
1 |
8352 |
◊ |
[C5Q]A:1217 |
-y,x-y+1,z+1/3 |
2_565 |
1 |
1 |
453 |
1.4 |
0.0 |
0.497 |
0 |
0 |
0 |
0.000 |
|