## |
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 |
77 |
23 |
13100 |
◊ |
A |
x,y-1,z |
1_545 |
83 |
29 |
13126 |
687.3 |
-2.5 |
0.489 |
6 |
2 |
0 |
0.000 |
2 |
|
B |
80 |
26 |
13100 |
◊ |
A |
x,y,z |
1_555 |
75 |
23 |
13126 |
678.4 |
-1.6 |
0.547 |
6 |
3 |
0 |
0.000 |
Average: |
682.9 |
-2.0 |
0.518 |
6 |
3 |
0 |
0.000 |
2 |
3 |
|
A |
36 |
14 |
13126 |
x |
A |
x-1,y,z |
1_455 |
22 |
7 |
13126 |
249.0 |
3.7 |
0.861 |
3 |
1 |
0 |
0.000 |
3 |
4 |
|
B |
30 |
11 |
13100 |
x |
B |
x-1,y,z |
1_455 |
31 |
12 |
13100 |
248.7 |
1.9 |
0.778 |
5 |
1 |
0 |
0.000 |
4 |
5 |
|
[QBS]A:401 |
13 |
1 |
367 |
f |
A |
x,y,z |
1_555 |
28 |
9 |
13126 |
200.9 |
-7.9 |
0.433 |
1 |
0 |
0 |
0.036 |
6 |
|
[QBS]B:401 |
13 |
1 |
365 |
f |
B |
x,y,z |
1_555 |
29 |
9 |
13100 |
192.4 |
-7.4 |
0.438 |
1 |
0 |
0 |
0.036 |
Average: |
196.7 |
-7.7 |
0.436 |
1 |
0 |
0 |
0.036 |
5 |
7 |
|
B |
20 |
6 |
13100 |
x |
B |
x,y-1,z |
1_545 |
24 |
12 |
13100 |
199.4 |
-1.2 |
0.431 |
0 |
0 |
0 |
0.000 |
8 |
|
A |
18 |
6 |
13126 |
x |
A |
x,y-1,z |
1_545 |
21 |
10 |
13126 |
176.1 |
-2.4 |
0.262 |
0 |
0 |
0 |
0.000 |
Average: |
187.8 |
-1.8 |
0.347 |
0 |
0 |
0 |
0.000 |
6 |
9 |
|
B |
18 |
9 |
13100 |
◊ |
A |
x,y-1,z+1 |
1_546 |
14 |
7 |
13126 |
125.1 |
1.9 |
0.818 |
3 |
2 |
0 |
0.000 |
10 |
|
A |
18 |
9 |
13126 |
◊ |
B |
x,y,z-1 |
1_554 |
13 |
7 |
13100 |
118.8 |
1.5 |
0.781 |
3 |
2 |
0 |
0.000 |
Average: |
122.0 |
1.7 |
0.800 |
3 |
2 |
0 |
0.000 |
7 |
11 |
|
[DMS]B:404 |
4 |
1 |
210 |
f |
B |
x,y,z |
1_555 |
21 |
8 |
13100 |
104.2 |
2.7 |
0.499 |
0 |
0 |
0 |
0.000 |
8 |
12 |
|
[DMS]B:405 |
4 |
1 |
210 |
f |
B |
x,y,z |
1_555 |
11 |
6 |
13100 |
104.0 |
0.9 |
0.365 |
0 |
0 |
0 |
0.000 |
9 |
13 |
|
[SO4]B:402 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
14 |
8 |
13100 |
100.1 |
-14.7 |
0.841 |
3 |
0 |
0 |
0.074 |
10 |
14 |
|
[SO4]A:403 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
14 |
8 |
13126 |
99.7 |
-14.8 |
0.842 |
3 |
0 |
0 |
0.045 |
11 |
15 |
|
[DMS]B:403 |
4 |
1 |
210 |
f |
B |
x,y,z |
1_555 |
14 |
6 |
13100 |
92.8 |
1.4 |
0.421 |
2 |
0 |
0 |
0.000 |
12 |
16 |
|
[QBS]A:401 |
9 |
1 |
367 |
◊ |
B |
x,y,z |
1_555 |
10 |
4 |
13100 |
91.7 |
-0.7 |
0.606 |
0 |
0 |
0 |
0.000 |
17 |
|
[QBS]B:401 |
9 |
1 |
365 |
◊ |
A |
x,y-1,z |
1_545 |
11 |
4 |
13126 |
91.0 |
-0.8 |
0.601 |
0 |
0 |
0 |
0.000 |
Average: |
91.4 |
-0.8 |
0.603 |
0 |
0 |
0 |
0.000 |
13 |
18 |
|
[SO4]A:402 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
15 |
7 |
13126 |
82.6 |
-10.6 |
0.788 |
1 |
0 |
0 |
0.031 |
14 |
19 |
|
B |
8 |
4 |
13100 |
◊ |
[DMS]B:403 |
x-1,y,z |
1_455 |
3 |
1 |
210 |
48.0 |
1.5 |
0.484 |
0 |
0 |
0 |
0.000 |
15 |
20 |
|
A |
2 |
1 |
13126 |
◊ |
[SO4]A:402 |
x-1,y,z |
1_455 |
4 |
1 |
184 |
31.4 |
-3.3 |
0.945 |
1 |
0 |
0 |
0.000 |
16 |
21 |
|
A |
2 |
2 |
13126 |
◊ |
B |
x-1,y,z |
1_455 |
6 |
2 |
13100 |
29.8 |
0.6 |
0.655 |
0 |
0 |
0 |
0.000 |
17 |
22 |
|
[DMS]B:405 |
3 |
1 |
210 |
f |
[QBS]B:401 |
x,y,z |
1_555 |
4 |
1 |
365 |
26.7 |
-1.8 |
0.254 |
0 |
0 |
0 |
0.008 |
18 |
23 |
|
[DMS]B:405 |
3 |
1 |
210 |
◊ |
A |
x,y-1,z |
1_545 |
1 |
1 |
13126 |
13.7 |
0.7 |
0.428 |
0 |
0 |
0 |
0.000 |
|