## |
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 |
126 |
37 |
17939 |
◊ |
A |
x,y,z |
1_555 |
107 |
29 |
17880 |
1149.2 |
3.3 |
0.494 |
7 |
0 |
0 |
0.000 |
2 |
2 |
|
A |
76 |
19 |
17880 |
◊ |
B |
x-1,y,z |
1_455 |
75 |
18 |
17939 |
667.1 |
1.2 |
0.486 |
3 |
3 |
0 |
0.000 |
3 |
3 |
|
B |
54 |
17 |
17939 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
59 |
20 |
17880 |
509.3 |
1.8 |
0.573 |
5 |
3 |
0 |
0.000 |
4 |
|
A |
55 |
16 |
17880 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
53 |
18 |
17939 |
495.5 |
2.7 |
0.626 |
5 |
4 |
0 |
0.000 |
Average: |
502.4 |
2.3 |
0.599 |
5 |
4 |
0 |
0.000 |
4 |
5 |
|
[5GP]A:503 |
22 |
1 |
498 |
f |
A |
x,y,z |
1_555 |
57 |
23 |
17880 |
319.7 |
-2.3 |
0.237 |
5 |
0 |
0 |
0.016 |
5 |
6 |
|
[SUC]B:513 |
16 |
1 |
461 |
◊ |
B |
x,y,z |
1_555 |
22 |
10 |
17939 |
183.3 |
2.0 |
0.447 |
1 |
0 |
0 |
0.000 |
7 |
|
[SUC]A:513 |
14 |
1 |
461 |
◊ |
A |
x,y,z |
1_555 |
21 |
10 |
17880 |
182.5 |
2.4 |
0.526 |
1 |
0 |
0 |
0.000 |
Average: |
182.9 |
2.2 |
0.486 |
1 |
0 |
0 |
0.000 |
6 |
8 |
|
[SO4]A:505 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
20 |
9 |
17880 |
105.7 |
-15.4 |
0.767 |
2 |
0 |
0 |
0.057 |
7 |
9 |
|
[SO4]A:504 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
15 |
8 |
17880 |
105.5 |
-16.4 |
0.516 |
3 |
0 |
0 |
0.062 |
8 |
10 |
|
[SO4]A:510 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
17880 |
104.4 |
-15.7 |
0.843 |
3 |
0 |
0 |
0.060 |
9 |
11 |
|
[SO4]B:507 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
15 |
7 |
17939 |
103.4 |
-16.3 |
0.533 |
4 |
0 |
0 |
0.063 |
10 |
12 |
|
[SO4]B:503 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
18 |
7 |
17939 |
99.7 |
-13.9 |
0.832 |
2 |
0 |
0 |
0.052 |
11 |
13 |
|
[SO4]B:506 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
13 |
4 |
17939 |
98.9 |
-15.0 |
0.692 |
4 |
0 |
0 |
0.059 |
12 |
14 |
|
[SO4]A:511 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
17880 |
92.3 |
-14.3 |
0.559 |
1 |
0 |
0 |
0.051 |
13 |
15 |
|
[SO4]A:509 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
13 |
3 |
17880 |
89.6 |
-11.8 |
0.756 |
3 |
0 |
0 |
0.046 |
14 |
16 |
|
[SO4]B:511 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
13 |
4 |
17939 |
88.1 |
-11.5 |
0.737 |
3 |
0 |
0 |
0.045 |
15 |
17 |
|
[SO4]B:508 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
17939 |
81.7 |
-10.9 |
0.772 |
2 |
0 |
0 |
0.041 |
16 |
18 |
|
[SO4]B:510 |
5 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
14 |
7 |
17880 |
81.6 |
-8.8 |
0.843 |
1 |
0 |
0 |
0.032 |
17 |
19 |
|
[SO4]A:512 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
17880 |
66.7 |
-9.7 |
0.574 |
2 |
0 |
0 |
0.037 |
18 |
20 |
|
[SO4]B:509 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
17939 |
65.4 |
-7.6 |
0.825 |
0 |
0 |
0 |
0.027 |
19 |
21 |
|
[SO4]B:510 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
17939 |
64.5 |
-9.4 |
0.578 |
2 |
0 |
0 |
0.036 |
20 |
22 |
|
[SO4]A:507 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
6 |
2 |
17880 |
63.9 |
-9.1 |
0.773 |
2 |
0 |
0 |
0.035 |
21 |
23 |
|
[SO4]B:504 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
6 |
3 |
17939 |
63.7 |
-8.4 |
0.814 |
2 |
0 |
0 |
0.033 |
22 |
24 |
|
[SO4]B:505 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
17939 |
61.7 |
-7.1 |
0.905 |
2 |
0 |
0 |
0.028 |
23 |
25 |
|
[SO4]A:508 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
8 |
6 |
17880 |
60.7 |
-7.8 |
0.598 |
1 |
0 |
0 |
0.029 |
24 |
26 |
|
[SO4]A:506 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
17880 |
59.7 |
-6.7 |
0.879 |
1 |
0 |
0 |
0.025 |
25 |
27 |
|
A |
8 |
2 |
17880 |
◊ |
[SO4]B:508 |
x-1,y,z |
1_455 |
4 |
1 |
185 |
55.4 |
-6.5 |
0.850 |
2 |
0 |
0 |
0.000 |
26 |
28 |
|
[MN]B:501 |
1 |
1 |
123 |
f |
B |
x,y,z |
1_555 |
6 |
5 |
17939 |
54.1 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.033 |
29 |
|
[MN]A:501 |
1 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
6 |
5 |
17880 |
44.5 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.033 |
Average: |
49.3 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.033 |
27 |
30 |
|
A |
9 |
5 |
17880 |
f |
[SO4]B:512 |
-x+1/2,-y,z-1/2 |
2_554 |
4 |
1 |
185 |
53.1 |
-5.6 |
0.879 |
0 |
0 |
0 |
0.020 |
28 |
31 |
|
[MN]B:502 |
1 |
1 |
123 |
f |
B |
x,y,z |
1_555 |
8 |
5 |
17939 |
52.8 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.031 |
32 |
|
[MN]A:502 |
1 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
17880 |
51.9 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.031 |
Average: |
52.3 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.031 |
29 |
33 |
|
[SO4]A:512 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
17939 |
39.5 |
-3.5 |
0.972 |
1 |
0 |
0 |
0.014 |
30 |
34 |
|
B |
4 |
1 |
17939 |
◊ |
[SO4]A:511 |
-x+1,y-1/2,-z+1/2 |
3_645 |
4 |
1 |
186 |
38.8 |
-3.9 |
0.837 |
0 |
0 |
0 |
0.000 |
31 |
35 |
|
[SO4]B:512 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
17939 |
35.8 |
-3.8 |
0.647 |
0 |
0 |
0 |
0.000 |
32 |
36 |
|
[SO4]A:510 |
3 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
17939 |
30.8 |
-3.5 |
0.800 |
0 |
0 |
0 |
0.012 |
33 |
37 |
|
A |
4 |
1 |
17880 |
◊ |
[SO4]B:509 |
x-1,y,z |
1_455 |
4 |
1 |
185 |
30.2 |
-3.9 |
0.424 |
0 |
0 |
0 |
0.000 |
34 |
38 |
|
[5GP]A:503 |
2 |
1 |
498 |
f |
[MN]A:501 |
x,y,z |
1_555 |
1 |
1 |
123 |
29.4 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.009 |
35 |
39 |
|
[MN]B:502 |
1 |
1 |
123 |
f |
[MN]B:501 |
x,y,z |
1_555 |
1 |
1 |
123 |
22.0 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.008 |
36 |
40 |
|
[MN]A:502 |
1 |
1 |
123 |
f |
[MN]A:501 |
x,y,z |
1_555 |
1 |
1 |
123 |
20.0 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.007 |
37 |
41 |
|
[SO4]B:510 |
3 |
1 |
186 |
◊ |
[SO4]A:505 |
x,y,z |
1_555 |
1 |
1 |
186 |
18.8 |
-4.5 |
0.891 |
0 |
0 |
0 |
0.016 |
38 |
42 |
|
[5GP]A:503 |
1 |
1 |
498 |
f |
[MN]A:502 |
x,y,z |
1_555 |
1 |
1 |
123 |
11.1 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.004 |
39 |
43 |
|
[SO4]B:503 |
3 |
1 |
185 |
f |
[MN]B:502 |
x,y,z |
1_555 |
1 |
1 |
123 |
11.0 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.007 |
40 |
44 |
|
[SO4]A:505 |
1 |
1 |
186 |
f |
[MN]A:502 |
x,y,z |
1_555 |
1 |
1 |
123 |
10.0 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.006 |
41 |
45 |
|
[SUC]A:513 |
2 |
1 |
461 |
◊ |
[SO4]B:512 |
-x+1/2,-y,z-1/2 |
2_554 |
3 |
1 |
185 |
9.0 |
-0.9 |
0.626 |
0 |
0 |
0 |
0.000 |
42 |
46 |
|
[SUC]B:513 |
1 |
1 |
461 |
◊ |
[SO4]B:508 |
x,y,z |
1_555 |
2 |
1 |
185 |
2.3 |
-0.2 |
0.564 |
0 |
0 |
0 |
0.000 |
43 |
47 |
|
[SO4]B:506 |
1 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
17880 |
1.7 |
-0.2 |
0.676 |
0 |
0 |
0 |
0.000 |
44 |
48 |
|
[SO4]B:506 |
1 |
1 |
186 |
◊ |
[SO4]A:512 |
x,y,z |
1_555 |
1 |
1 |
185 |
0.9 |
-0.2 |
1.000 |
0 |
0 |
0 |
0.000 |
|