## |
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 |
93 |
27 |
13123 |
◊ |
A |
x,y,z |
1_555 |
91 |
26 |
13538 |
864.0 |
-7.8 |
0.124 |
11 |
10 |
0 |
0.058 |
2 |
2 |
|
C |
97 |
23 |
13123 |
x |
C |
x-1,y,z |
1_455 |
92 |
25 |
13123 |
849.7 |
-3.7 |
0.326 |
14 |
5 |
0 |
0.000 |
3 |
|
A |
89 |
25 |
13538 |
x |
A |
x-1,y,z |
1_455 |
97 |
24 |
13538 |
829.5 |
-5.2 |
0.240 |
11 |
0 |
0 |
0.000 |
Average: |
839.6 |
-4.5 |
0.283 |
13 |
3 |
0 |
0.000 |
3 |
4 |
|
A |
56 |
18 |
13538 |
x |
A |
x,y,z-1 |
1_554 |
56 |
15 |
13538 |
502.1 |
-2.1 |
0.361 |
6 |
2 |
0 |
0.000 |
4 |
5 |
|
A |
54 |
17 |
13538 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
60 |
20 |
13123 |
499.9 |
3.6 |
0.818 |
9 |
3 |
0 |
0.003 |
5 |
6 |
|
[W4M]C:402 |
30 |
1 |
723 |
f |
C |
x,y,z |
1_555 |
51 |
24 |
13123 |
443.2 |
-10.8 |
0.147 |
6 |
0 |
0 |
0.055 |
6 |
7 |
|
[W4M]A:402 |
30 |
1 |
713 |
f |
A |
x,y,z |
1_555 |
56 |
25 |
13538 |
443.1 |
-10.3 |
0.163 |
6 |
0 |
0 |
0.053 |
7 |
8 |
|
A |
38 |
13 |
13538 |
◊ |
C |
-x,y-1/2,-z+1 |
2_546 |
43 |
10 |
13123 |
393.9 |
1.2 |
0.667 |
7 |
0 |
0 |
0.000 |
9 |
|
A |
30 |
9 |
13538 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
27 |
13 |
13123 |
223.8 |
0.6 |
0.625 |
2 |
1 |
0 |
0.000 |
Average: |
308.9 |
0.9 |
0.646 |
5 |
1 |
0 |
0.000 |
8 |
10 |
|
C |
20 |
5 |
13123 |
x |
C |
x,y,z-1 |
1_554 |
23 |
11 |
13123 |
244.4 |
1.3 |
0.709 |
2 |
1 |
0 |
0.000 |
9 |
11 |
|
[GOL]C:407 |
6 |
1 |
221 |
f |
C |
x,y,z |
1_555 |
31 |
12 |
13123 |
151.1 |
-0.7 |
0.477 |
3 |
0 |
0 |
0.009 |
10 |
12 |
|
[GOL]A:408 |
6 |
1 |
222 |
f |
A |
x,y,z |
1_555 |
28 |
11 |
13538 |
150.1 |
-0.8 |
0.458 |
3 |
0 |
0 |
0.009 |
11 |
13 |
|
[GOL]A:401 |
6 |
1 |
220 |
f |
A |
x,y,z |
1_555 |
29 |
10 |
13538 |
135.6 |
-0.8 |
0.472 |
5 |
0 |
0 |
0.012 |
12 |
14 |
|
[GOL]C:401 |
6 |
1 |
218 |
f |
C |
x,y,z |
1_555 |
30 |
10 |
13123 |
131.7 |
-0.8 |
0.471 |
5 |
0 |
0 |
0.012 |
13 |
15 |
|
[SO4]A:403 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
13 |
8 |
13538 |
104.3 |
-16.7 |
0.583 |
5 |
0 |
0 |
0.078 |
14 |
16 |
|
[SO4]A:404 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
15 |
5 |
13538 |
90.1 |
-12.7 |
0.786 |
5 |
0 |
0 |
0.061 |
15 |
17 |
|
[SO4]C:403 |
5 |
1 |
184 |
f |
C |
x,y,z-1 |
1_554 |
11 |
6 |
13123 |
89.2 |
-12.2 |
0.782 |
1 |
0 |
0 |
0.052 |
16 |
18 |
|
[GOL]A:407 |
6 |
1 |
221 |
f |
A |
x,y,z |
1_555 |
11 |
3 |
13538 |
87.7 |
-0.0 |
0.569 |
2 |
0 |
0 |
0.004 |
17 |
19 |
|
A |
12 |
6 |
13538 |
f |
[SO4]C:404 |
-x,y-1/2,-z |
2_545 |
5 |
1 |
183 |
83.6 |
-11.5 |
0.892 |
5 |
0 |
0 |
0.056 |
18 |
20 |
|
[SO4]A:405 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
13538 |
80.3 |
-11.6 |
0.715 |
2 |
0 |
0 |
0.051 |
19 |
21 |
|
[SO4]C:405 |
5 |
1 |
183 |
f |
C |
x,y,z |
1_555 |
13 |
6 |
13123 |
78.9 |
-10.2 |
0.889 |
4 |
0 |
0 |
0.049 |
20 |
22 |
|
A |
12 |
5 |
13538 |
◊ |
[SO4]C:405 |
-x,y-1/2,-z |
2_545 |
5 |
1 |
183 |
69.2 |
-9.0 |
0.797 |
2 |
0 |
0 |
0.040 |
21 |
23 |
|
C |
9 |
3 |
13123 |
f |
[SO4]C:406 |
x-1,y,z |
1_455 |
5 |
1 |
185 |
67.9 |
-8.1 |
0.891 |
1 |
0 |
0 |
0.035 |
22 |
24 |
|
[SO4]C:403 |
5 |
1 |
184 |
◊ |
C |
x,y,z |
1_555 |
7 |
3 |
13123 |
65.2 |
-8.0 |
0.856 |
2 |
0 |
0 |
0.000 |
23 |
25 |
|
[SO4]A:406 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
13538 |
64.5 |
-7.6 |
0.910 |
3 |
0 |
0 |
0.036 |
24 |
26 |
|
[SO4]A:406 |
4 |
1 |
184 |
◊ |
A |
x-1,y,z |
1_455 |
11 |
4 |
13538 |
64.0 |
-8.4 |
0.738 |
0 |
0 |
0 |
0.000 |
25 |
27 |
|
[SO4]C:404 |
4 |
1 |
183 |
◊ |
C |
x,y,z |
1_555 |
11 |
5 |
13123 |
63.1 |
-7.8 |
0.823 |
1 |
0 |
0 |
0.034 |
26 |
28 |
|
[SO4]C:406 |
5 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
7 |
3 |
13123 |
59.1 |
-6.4 |
0.933 |
3 |
0 |
0 |
0.000 |
27 |
29 |
|
A |
6 |
2 |
13538 |
◊ |
[W4M]C:402 |
-x+1,y-1/2,-z+1 |
2_646 |
4 |
1 |
723 |
43.6 |
0.8 |
0.845 |
0 |
0 |
0 |
0.000 |
28 |
30 |
|
[ZN]A:409 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
6 |
13538 |
37.1 |
-27.0 |
0.000 |
0 |
0 |
0 |
0.222 |
31 |
|
[ZN]C:408 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
9 |
6 |
13123 |
36.6 |
-27.1 |
0.000 |
0 |
0 |
0 |
0.222 |
Average: |
36.9 |
-27.1 |
0.000 |
0 |
0 |
0 |
0.222 |
29 |
32 |
|
[SO4]A:405 |
4 |
1 |
184 |
◊ |
C |
x,y,z |
1_555 |
5 |
1 |
13123 |
34.5 |
-4.5 |
0.699 |
0 |
0 |
0 |
0.019 |
30 |
33 |
|
[ZN]A:409 |
1 |
1 |
98 |
f |
[W4M]A:402 |
x,y,z |
1_555 |
4 |
1 |
713 |
31.7 |
-14.7 |
0.000 |
0 |
0 |
0 |
0.120 |
34 |
|
[ZN]C:408 |
1 |
1 |
98 |
f |
[W4M]C:402 |
x,y,z |
1_555 |
4 |
1 |
723 |
31.6 |
-14.6 |
0.000 |
0 |
0 |
0 |
0.120 |
Average: |
31.6 |
-14.7 |
0.000 |
0 |
0 |
0 |
0.120 |
31 |
35 |
|
[GOL]C:407 |
3 |
1 |
221 |
f |
[GOL]C:401 |
x,y,z |
1_555 |
2 |
1 |
218 |
25.7 |
-0.4 |
0.517 |
0 |
0 |
0 |
0.003 |
36 |
|
[GOL]A:408 |
3 |
1 |
222 |
f |
[GOL]A:401 |
x,y,z |
1_555 |
3 |
1 |
220 |
25.2 |
-0.4 |
0.458 |
0 |
0 |
0 |
0.003 |
Average: |
25.5 |
-0.4 |
0.488 |
0 |
0 |
0 |
0.003 |
32 |
37 |
|
A |
3 |
1 |
13538 |
◊ |
C |
-x+1,y-1/2,-z |
2_645 |
4 |
1 |
13123 |
19.3 |
-0.1 |
0.509 |
0 |
0 |
0 |
0.000 |
33 |
38 |
|
[SO4]A:404 |
3 |
1 |
185 |
f |
[GOL]A:407 |
x,y,z |
1_555 |
3 |
1 |
221 |
15.1 |
-1.4 |
0.704 |
0 |
0 |
0 |
0.006 |
34 |
39 |
|
A |
1 |
1 |
13538 |
◊ |
[W4M]A:402 |
x,y,z-1 |
1_554 |
5 |
1 |
713 |
13.9 |
0.1 |
0.854 |
0 |
0 |
0 |
0.000 |
35 |
40 |
|
A |
1 |
1 |
13538 |
◊ |
[SO4]A:403 |
x-1,y,z |
1_455 |
1 |
1 |
184 |
12.9 |
-1.4 |
0.825 |
0 |
0 |
0 |
0.000 |
36 |
41 |
|
[SO4]A:404 |
1 |
1 |
185 |
◊ |
A |
x,y,z-1 |
1_554 |
2 |
1 |
13538 |
6.7 |
-0.9 |
0.570 |
0 |
0 |
0 |
0.000 |
37 |
42 |
|
[W4M]A:402 |
1 |
1 |
713 |
◊ |
C |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
13123 |
2.3 |
0.1 |
0.777 |
0 |
0 |
0 |
0.000 |
38 |
43 |
|
C |
1 |
1 |
13123 |
x |
C |
x-1,y,z-1 |
1_454 |
1 |
1 |
13123 |
1.7 |
-0.0 |
0.572 |
0 |
0 |
0 |
0.000 |
39 |
44 |
|
[GOL]A:407 |
1 |
1 |
221 |
◊ |
A |
x,y,z-1 |
1_554 |
1 |
1 |
13538 |
1.3 |
0.1 |
0.613 |
0 |
0 |
0 |
0.000 |
|