## |
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 |
56 |
13 |
8792 |
◊ |
C |
-y+1/2,x-1/2,z+1/4 |
3_545 |
53 |
13 |
8867 |
450.0 |
-2.5 |
0.395 |
2 |
0 |
0 |
0.079 |
2 |
|
B |
50 |
12 |
8792 |
◊ |
A |
-y+1/2,x-1/2,z+1/4 |
3_545 |
54 |
12 |
8869 |
447.3 |
-2.4 |
0.408 |
2 |
0 |
0 |
0.079 |
3 |
|
C |
55 |
13 |
8867 |
◊ |
A |
x,y,z |
1_555 |
51 |
12 |
8869 |
440.1 |
-2.5 |
0.419 |
3 |
0 |
0 |
0.079 |
Average: |
445.8 |
-2.4 |
0.408 |
2 |
0 |
0 |
0.079 |
2 |
4 |
|
C |
40 |
13 |
8867 |
x |
C |
-y+1/2,x-1/2,z+1/4 |
3_545 |
50 |
14 |
8867 |
441.9 |
0.8 |
0.669 |
4 |
7 |
0 |
0.000 |
5 |
|
B |
36 |
11 |
8792 |
x |
A |
x,y,z |
1_555 |
55 |
17 |
8869 |
439.9 |
-0.9 |
0.542 |
6 |
7 |
0 |
0.000 |
Average: |
440.9 |
-0.0 |
0.605 |
5 |
7 |
0 |
0.000 |
3 |
6 |
|
B |
32 |
9 |
8792 |
◊ |
B |
y,x,-z+1 |
7_556 |
32 |
9 |
8792 |
321.9 |
1.0 |
0.687 |
6 |
4 |
0 |
0.000 |
4 |
7 |
|
[1GP]B:11 |
10 |
1 |
318 |
f |
B |
x,y,z |
1_555 |
44 |
17 |
8792 |
223.2 |
-5.3 |
0.488 |
8 |
0 |
0 |
0.067 |
5 |
8 |
|
[1GP]C:13 |
10 |
1 |
317 |
f |
C |
x,y,z |
1_555 |
44 |
18 |
8867 |
221.3 |
-5.0 |
0.498 |
6 |
0 |
0 |
0.058 |
6 |
9 |
|
[1GP]A:9 |
10 |
1 |
319 |
f |
A |
x,y,z |
1_555 |
44 |
18 |
8869 |
216.0 |
-4.9 |
0.532 |
10 |
0 |
0 |
0.071 |
7 |
10 |
|
B |
8 |
3 |
8792 |
f |
[SO4]C:10 |
-y+1/2,x-1/2,z+1/4 |
3_545 |
5 |
1 |
185 |
78.4 |
-9.8 |
0.927 |
6 |
0 |
0 |
0.095 |
8 |
11 |
|
[SO4]A:8 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
8869 |
74.7 |
-9.6 |
0.881 |
2 |
0 |
0 |
0.080 |
9 |
12 |
|
[SO4]A:12 |
5 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
11 |
4 |
8867 |
73.7 |
-8.5 |
0.905 |
3 |
0 |
0 |
0.075 |
10 |
13 |
|
A |
9 |
4 |
8869 |
◊ |
C |
-y+1/2,x-1/2,z+1/4 |
3_545 |
8 |
4 |
8867 |
68.9 |
-0.5 |
0.484 |
0 |
0 |
0 |
0.000 |
11 |
14 |
|
[SO4]C:3 |
4 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
9 |
5 |
8867 |
60.5 |
-8.3 |
0.752 |
2 |
0 |
0 |
0.070 |
12 |
15 |
|
[SO4]B:1 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
5 |
2 |
8792 |
58.7 |
-5.6 |
0.960 |
4 |
0 |
0 |
0.056 |
13 |
16 |
|
[SO4]C:2 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
6 |
2 |
8867 |
57.7 |
-6.3 |
0.933 |
3 |
0 |
0 |
0.058 |
14 |
17 |
|
[CL]A:4 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
8869 |
42.2 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.067 |
18 |
|
[CL]B:5 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
4 |
3 |
8792 |
32.8 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.067 |
Average: |
37.5 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.067 |
15 |
19 |
|
[CL]B:7 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
7 |
4 |
8792 |
39.7 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.069 |
20 |
|
[CL]C:6 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
8 |
4 |
8867 |
35.2 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.069 |
Average: |
37.4 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.069 |
16 |
21 |
|
[SO4]A:12 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
8869 |
35.9 |
-3.8 |
0.941 |
1 |
0 |
0 |
0.033 |
17 |
22 |
|
B |
4 |
2 |
8792 |
◊ |
[SO4]A:8 |
-y+1/2,x-1/2,z+1/4 |
3_545 |
4 |
1 |
186 |
35.7 |
-2.2 |
0.964 |
1 |
0 |
0 |
0.020 |
18 |
23 |
|
[SO4]C:10 |
4 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
8867 |
31.4 |
-3.6 |
0.914 |
0 |
0 |
0 |
0.027 |
19 |
24 |
|
[SO4]C:2 |
2 |
1 |
185 |
◊ |
C |
-y+1/2,x-1/2,z+1/4 |
3_545 |
6 |
4 |
8867 |
25.8 |
-3.1 |
0.761 |
0 |
0 |
0 |
0.000 |
20 |
25 |
|
[SO4]C:10 |
3 |
1 |
185 |
◊ |
[SO4]A:8 |
x,y,z |
1_555 |
3 |
1 |
186 |
25.3 |
-5.7 |
0.992 |
0 |
0 |
0 |
0.043 |
21 |
26 |
|
[1GP]C:13 |
2 |
1 |
317 |
◊ |
C |
-y+1/2,x-1/2,z+1/4 |
3_545 |
5 |
2 |
8867 |
23.7 |
0.8 |
0.743 |
0 |
0 |
0 |
0.000 |
22 |
27 |
|
[SO4]B:1 |
3 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
7 |
5 |
8869 |
17.0 |
-1.9 |
0.798 |
0 |
0 |
0 |
0.000 |
23 |
28 |
|
[SO4]C:10 |
3 |
1 |
185 |
◊ |
[SO4]A:12 |
x,y,z |
1_555 |
3 |
1 |
186 |
12.5 |
-2.7 |
0.992 |
0 |
0 |
0 |
0.020 |
24 |
29 |
|
[SO4]A:8 |
1 |
1 |
186 |
◊ |
[SO4]A:12 |
x,y,z |
1_555 |
1 |
1 |
186 |
6.0 |
-1.4 |
0.800 |
0 |
0 |
0 |
0.011 |
|