## |
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 |
|
C |
142 |
38 |
12043 |
◊ |
A |
x,y,z |
1_555 |
121 |
33 |
12104 |
1205.6 |
-17.7 |
0.079 |
10 |
3 |
0 |
0.670 |
2 |
|
B |
123 |
33 |
11423 |
◊ |
A |
x,y,z |
1_555 |
137 |
36 |
12104 |
1204.1 |
-17.9 |
0.058 |
14 |
4 |
0 |
0.670 |
3 |
|
C |
115 |
33 |
12043 |
◊ |
B |
x,y,z |
1_555 |
117 |
32 |
11423 |
1090.0 |
-16.0 |
0.076 |
10 |
5 |
0 |
0.670 |
Average: |
1166.6 |
-17.2 |
0.071 |
11 |
4 |
0 |
0.670 |
2 |
4 |
|
A |
48 |
14 |
12104 |
◊ |
C |
-x-1,y-1/2,-z-1/2 |
3_444 |
55 |
17 |
12043 |
471.6 |
-0.7 |
0.711 |
4 |
4 |
0 |
0.000 |
3 |
5 |
|
C |
44 |
11 |
12043 |
x |
C |
x-1/2,-y+1/2,-z |
4_455 |
47 |
16 |
12043 |
429.5 |
-4.2 |
0.378 |
4 |
2 |
0 |
0.000 |
4 |
6 |
|
B |
43 |
11 |
11423 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
37 |
7 |
12104 |
356.0 |
1.8 |
0.822 |
5 |
3 |
0 |
0.000 |
5 |
7 |
|
A |
31 |
11 |
12104 |
◊ |
C |
x-1/2,-y+1/2,-z |
4_455 |
35 |
14 |
12043 |
304.6 |
2.5 |
0.883 |
6 |
6 |
0 |
0.000 |
6 |
8 |
|
[GMP]C:301 |
20 |
1 |
414 |
f |
C |
x,y,z |
1_555 |
42 |
18 |
12043 |
238.0 |
0.6 |
0.473 |
7 |
0 |
0 |
0.050 |
9 |
|
[GMP]A:300 |
20 |
1 |
413 |
f |
A |
x,y,z |
1_555 |
42 |
18 |
12104 |
237.2 |
0.6 |
0.405 |
7 |
0 |
0 |
0.050 |
Average: |
237.6 |
0.6 |
0.439 |
7 |
0 |
0 |
0.050 |
7 |
10 |
|
[DMS]A:703 |
4 |
1 |
213 |
f |
A |
x,y,z |
1_555 |
25 |
13 |
12104 |
140.4 |
5.7 |
0.645 |
1 |
0 |
0 |
0.000 |
8 |
11 |
|
[DMS]C:705 |
4 |
1 |
215 |
f |
C |
x,y,z |
1_555 |
25 |
12 |
12043 |
138.7 |
5.6 |
0.646 |
1 |
0 |
0 |
0.000 |
12 |
|
[DMS]B:704 |
4 |
1 |
213 |
f |
B |
x,y,z |
1_555 |
24 |
12 |
11423 |
138.3 |
5.7 |
0.648 |
1 |
0 |
0 |
0.000 |
Average: |
138.5 |
5.6 |
0.647 |
1 |
0 |
0 |
0.000 |
9 |
13 |
|
[ACT]B:701 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
21 |
10 |
11423 |
115.0 |
-0.7 |
0.671 |
0 |
0 |
0 |
0.006 |
10 |
14 |
|
B |
13 |
5 |
11423 |
x |
B |
x-1,y,z |
1_455 |
14 |
4 |
11423 |
98.5 |
-0.7 |
0.507 |
0 |
1 |
0 |
0.000 |
11 |
15 |
|
[SO4]A:302 |
5 |
1 |
189 |
f |
A |
x,y,z |
1_555 |
19 |
10 |
12104 |
98.5 |
-14.7 |
0.798 |
5 |
0 |
0 |
0.166 |
12 |
16 |
|
[SO4]C:303 |
5 |
1 |
188 |
f |
C |
x,y,z |
1_555 |
20 |
10 |
12043 |
98.1 |
-14.8 |
0.807 |
7 |
0 |
0 |
0.175 |
13 |
17 |
|
B |
9 |
2 |
11423 |
◊ |
C |
-x-1,y-1/2,-z-1/2 |
3_444 |
7 |
3 |
12043 |
73.0 |
-0.9 |
0.407 |
0 |
0 |
0 |
0.000 |
14 |
18 |
|
[DMS]B:706 |
4 |
1 |
214 |
◊ |
C |
x,y,z |
1_555 |
11 |
4 |
12043 |
65.6 |
1.6 |
0.383 |
0 |
0 |
0 |
0.000 |
15 |
19 |
|
[DMS]B:706 |
4 |
1 |
214 |
◊ |
B |
x,y,z |
1_555 |
12 |
5 |
11423 |
63.5 |
0.8 |
0.291 |
0 |
0 |
0 |
0.000 |
16 |
20 |
|
[DMS]B:706 |
4 |
1 |
214 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
12104 |
54.5 |
-0.0 |
0.311 |
0 |
0 |
0 |
0.000 |
17 |
21 |
|
B |
4 |
3 |
11423 |
x |
B |
x-1/2,-y+1/2,-z-1 |
4_454 |
7 |
4 |
11423 |
46.9 |
0.0 |
0.466 |
0 |
0 |
0 |
0.000 |
18 |
22 |
|
[GMP]A:300 |
5 |
1 |
413 |
◊ |
B |
x,y,z |
1_555 |
7 |
1 |
11423 |
45.8 |
0.5 |
0.378 |
0 |
0 |
0 |
0.000 |
23 |
|
[GMP]C:301 |
5 |
1 |
414 |
◊ |
A |
x,y,z |
1_555 |
7 |
1 |
12104 |
44.8 |
0.4 |
0.363 |
0 |
0 |
0 |
0.000 |
Average: |
45.3 |
0.5 |
0.370 |
0 |
0 |
0 |
0.000 |
19 |
24 |
|
[SO4]A:302 |
4 |
1 |
189 |
f |
[GMP]A:300 |
x,y,z |
1_555 |
5 |
1 |
413 |
42.1 |
-5.9 |
0.406 |
0 |
0 |
0 |
0.058 |
20 |
25 |
|
[SO4]C:303 |
4 |
1 |
188 |
f |
[GMP]C:301 |
x,y,z |
1_555 |
5 |
1 |
414 |
41.1 |
-5.7 |
0.452 |
0 |
0 |
0 |
0.056 |
21 |
26 |
|
C |
3 |
1 |
12043 |
x |
C |
x-1,y,z |
1_455 |
6 |
3 |
12043 |
35.0 |
0.8 |
0.848 |
2 |
2 |
0 |
0.000 |
22 |
27 |
|
A |
7 |
3 |
12104 |
◊ |
B |
-x-1,y-1/2,-z-1/2 |
3_444 |
3 |
2 |
11423 |
32.7 |
-0.3 |
0.400 |
0 |
0 |
0 |
0.000 |
23 |
28 |
|
B |
5 |
4 |
11423 |
◊ |
A |
-x-3/2,-y,z-1/2 |
2_354 |
6 |
3 |
12104 |
31.6 |
0.1 |
0.668 |
0 |
0 |
0 |
0.000 |
24 |
29 |
|
A |
3 |
2 |
12104 |
x |
A |
x-1,y,z |
1_455 |
2 |
1 |
12104 |
25.0 |
-0.3 |
0.327 |
0 |
0 |
0 |
0.000 |
25 |
30 |
|
A |
2 |
1 |
12104 |
◊ |
C |
x-1,y,z |
1_455 |
3 |
1 |
12043 |
7.3 |
-0.1 |
0.527 |
0 |
0 |
0 |
0.000 |
26 |
31 |
|
[SO4]A:302 |
1 |
1 |
189 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
11423 |
2.1 |
-0.3 |
0.643 |
0 |
0 |
0 |
0.003 |
27 |
32 |
|
[SO4]C:303 |
1 |
1 |
188 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
12104 |
1.6 |
-0.2 |
0.662 |
0 |
0 |
0 |
0.002 |
|