## |
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 |
|
D |
168 |
43 |
12391 |
◊ |
A |
x,y,z |
1_555 |
164 |
45 |
11559 |
1476.4 |
-21.1 |
0.071 |
17 |
0 |
0 |
0.767 |
2 |
|
C |
156 |
42 |
12254 |
◊ |
B |
x,y,z |
1_555 |
159 |
41 |
11498 |
1423.7 |
-20.1 |
0.071 |
14 |
0 |
0 |
0.767 |
Average: |
1450.1 |
-20.6 |
0.071 |
16 |
0 |
0 |
0.767 |
2 |
3 |
|
D |
101 |
24 |
12391 |
◊ |
C |
x,y,z |
1_555 |
103 |
25 |
12254 |
920.4 |
-8.6 |
0.307 |
10 |
0 |
0 |
0.605 |
4 |
|
B |
99 |
22 |
11498 |
◊ |
A |
x,y,z |
1_555 |
94 |
23 |
11559 |
820.0 |
-8.0 |
0.296 |
11 |
0 |
0 |
0.605 |
Average: |
870.2 |
-8.3 |
0.302 |
11 |
0 |
0 |
0.605 |
3 |
5 |
|
C |
93 |
27 |
12254 |
◊ |
B |
x-1,y,z |
1_455 |
91 |
26 |
11498 |
847.3 |
-3.3 |
0.591 |
9 |
3 |
0 |
0.000 |
4 |
6 |
|
A |
64 |
18 |
11559 |
◊ |
C |
-x-1,y-1/2,-z-1/2 |
3_444 |
69 |
17 |
12254 |
601.4 |
-3.0 |
0.591 |
5 |
3 |
0 |
0.083 |
5 |
7 |
|
A |
71 |
20 |
11559 |
◊ |
C |
-x-1/2,-y,z-1/2 |
2_454 |
51 |
12 |
12254 |
531.3 |
-6.5 |
0.273 |
4 |
0 |
0 |
0.082 |
6 |
8 |
|
B |
44 |
9 |
11498 |
◊ |
D |
-x-1,y-1/2,-z-1/2 |
3_444 |
58 |
18 |
12391 |
481.6 |
-1.4 |
0.532 |
7 |
6 |
0 |
0.080 |
7 |
9 |
|
D |
42 |
6 |
12391 |
◊ |
B |
-x-1/2,-y,z-1/2 |
2_454 |
54 |
17 |
11498 |
478.2 |
-4.7 |
0.249 |
7 |
0 |
0 |
0.077 |
8 |
10 |
|
A |
36 |
11 |
11559 |
◊ |
B |
-x-1/2,-y,z-1/2 |
2_454 |
34 |
10 |
11498 |
317.1 |
2.6 |
0.882 |
6 |
5 |
0 |
0.008 |
9 |
11 |
|
[34X]B:1248 |
22 |
1 |
481 |
◊ |
B |
x,y,z |
1_555 |
36 |
12 |
11498 |
219.4 |
-3.4 |
0.450 |
1 |
0 |
0 |
0.182 |
12 |
|
[34X]C:1248 |
23 |
1 |
485 |
◊ |
C |
x,y,z |
1_555 |
39 |
12 |
12254 |
219.2 |
-2.8 |
0.510 |
1 |
0 |
0 |
0.182 |
Average: |
219.3 |
-3.1 |
0.480 |
1 |
0 |
0 |
0.182 |
10 |
13 |
|
[34X]B:1248 |
23 |
1 |
481 |
f |
A |
x,y,z |
1_555 |
36 |
12 |
11559 |
216.4 |
-4.1 |
0.426 |
1 |
0 |
0 |
0.233 |
14 |
|
[34X]C:1248 |
23 |
1 |
485 |
f |
D |
x,y,z |
1_555 |
36 |
12 |
12391 |
216.0 |
-3.7 |
0.406 |
1 |
0 |
0 |
0.233 |
Average: |
216.2 |
-3.9 |
0.416 |
1 |
0 |
0 |
0.233 |
11 |
15 |
|
A |
20 |
6 |
11559 |
◊ |
D |
-x-1,y-1/2,-z-1/2 |
3_444 |
25 |
5 |
12391 |
207.2 |
-1.4 |
0.253 |
3 |
2 |
0 |
0.045 |
12 |
16 |
|
D |
20 |
7 |
12391 |
◊ |
B |
x,y,z |
1_555 |
26 |
8 |
11498 |
193.5 |
3.0 |
0.908 |
4 |
0 |
0 |
0.000 |
17 |
|
C |
18 |
7 |
12254 |
◊ |
A |
x,y,z |
1_555 |
22 |
7 |
11559 |
187.5 |
2.3 |
0.895 |
3 |
0 |
0 |
0.000 |
Average: |
190.5 |
2.7 |
0.901 |
4 |
0 |
0 |
0.000 |
13 |
18 |
|
D |
21 |
6 |
12391 |
◊ |
A |
x-1,y,z |
1_455 |
19 |
5 |
11559 |
169.0 |
-0.2 |
0.584 |
2 |
0 |
0 |
0.000 |
14 |
19 |
|
B |
15 |
5 |
11498 |
◊ |
D |
-x,y-1/2,-z-1/2 |
3_544 |
17 |
3 |
12391 |
128.5 |
0.2 |
0.695 |
3 |
0 |
0 |
0.000 |
15 |
20 |
|
[SO4]C:1249 |
5 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
12 |
5 |
12254 |
76.6 |
-11.2 |
0.602 |
2 |
0 |
0 |
0.372 |
16 |
21 |
|
A |
3 |
3 |
11559 |
◊ |
B |
-x,y-1/2,-z-1/2 |
3_544 |
4 |
2 |
11498 |
49.9 |
0.3 |
0.594 |
1 |
0 |
0 |
0.000 |
17 |
22 |
|
C |
7 |
3 |
12254 |
◊ |
D |
-x-1,y-1/2,-z-1/2 |
3_444 |
9 |
5 |
12391 |
45.3 |
0.9 |
0.817 |
0 |
1 |
0 |
0.000 |
18 |
23 |
|
[SO4]C:1249 |
4 |
1 |
187 |
◊ |
B |
x,y,z |
1_555 |
8 |
2 |
11498 |
40.8 |
-4.9 |
0.805 |
0 |
0 |
0 |
0.113 |
19 |
24 |
|
A |
2 |
1 |
11559 |
◊ |
[SO4]C:1249 |
-x-1/2,-y,z-1/2 |
2_454 |
4 |
1 |
187 |
34.3 |
-2.9 |
0.978 |
1 |
0 |
0 |
0.034 |
20 |
25 |
|
C |
3 |
2 |
12254 |
x |
C |
x-1/2,-y+1/2,-z |
4_455 |
2 |
2 |
12254 |
9.3 |
0.0 |
0.647 |
0 |
0 |
0 |
0.000 |
21 |
26 |
|
A |
1 |
1 |
11559 |
◊ |
C |
-x,y-1/2,-z-1/2 |
3_544 |
2 |
1 |
12254 |
3.5 |
0.0 |
0.518 |
0 |
0 |
0 |
0.000 |
|