## |
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 |
92 |
25 |
10243 |
◊ |
A |
-y,x-y-1,z-1/3 |
3_544 |
86 |
23 |
10134 |
812.5 |
-13.7 |
0.023 |
6 |
0 |
0 |
1.000 |
2 |
2 |
|
B |
39 |
12 |
10243 |
x |
B |
x-y,x,z-1/6 |
2_554 |
60 |
19 |
10243 |
478.7 |
-6.2 |
0.140 |
1 |
0 |
0 |
0.000 |
3 |
|
A |
52 |
15 |
10134 |
x |
A |
x-y,x-1,z-1/6 |
2_544 |
39 |
13 |
10134 |
454.7 |
-7.1 |
0.095 |
1 |
0 |
0 |
0.000 |
Average: |
466.7 |
-6.6 |
0.118 |
1 |
0 |
0 |
0.000 |
3 |
4 |
|
[2WL]B:201 |
27 |
1 |
602 |
f |
B |
x,y,z |
1_555 |
63 |
28 |
10243 |
394.6 |
-3.0 |
0.247 |
1 |
0 |
0 |
1.000 |
5 |
|
[2WL]A:201 |
27 |
1 |
603 |
f |
A |
x,y,z |
1_555 |
66 |
28 |
10134 |
389.9 |
-2.8 |
0.276 |
1 |
0 |
0 |
1.000 |
Average: |
392.2 |
-2.9 |
0.261 |
1 |
0 |
0 |
1.000 |
4 |
6 |
|
B |
33 |
7 |
10243 |
◊ |
A |
-x+1,-y,z-1/2 |
4_654 |
31 |
7 |
10134 |
273.2 |
-3.5 |
0.266 |
2 |
0 |
0 |
0.000 |
5 |
7 |
|
[EDO]B:203 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
22 |
7 |
10243 |
118.3 |
3.5 |
0.604 |
2 |
0 |
0 |
0.000 |
6 |
8 |
|
[EDO]B:205 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
19 |
6 |
10243 |
117.2 |
3.5 |
0.483 |
3 |
0 |
0 |
0.000 |
7 |
9 |
|
[EDO]A:203 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
21 |
6 |
10134 |
115.9 |
3.4 |
0.480 |
3 |
0 |
0 |
0.000 |
8 |
10 |
|
[EDO]A:213 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
19 |
8 |
10134 |
111.5 |
3.6 |
0.468 |
0 |
0 |
0 |
0.000 |
9 |
11 |
|
[EDO]A:205 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
21 |
6 |
10134 |
111.0 |
3.2 |
0.609 |
2 |
0 |
0 |
0.000 |
10 |
12 |
|
B |
16 |
3 |
10243 |
◊ |
[2WL]A:201 |
-y,x-y-1,z-1/3 |
3_544 |
10 |
1 |
603 |
108.1 |
-1.8 |
0.325 |
0 |
0 |
0 |
1.000 |
13 |
|
[2WL]B:201 |
8 |
1 |
602 |
◊ |
A |
-y,x-y-1,z-1/3 |
3_544 |
16 |
3 |
10134 |
101.7 |
-1.1 |
0.404 |
0 |
0 |
0 |
1.000 |
Average: |
104.9 |
-1.4 |
0.365 |
0 |
0 |
0 |
1.000 |
11 |
14 |
|
[EDO]A:209 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
19 |
9 |
10134 |
104.5 |
3.3 |
0.516 |
3 |
0 |
0 |
0.000 |
12 |
15 |
|
[EDO]A:214 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
16 |
5 |
10134 |
104.1 |
2.7 |
0.406 |
1 |
0 |
0 |
0.000 |
13 |
16 |
|
[EDO]A:212 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
10134 |
98.1 |
3.3 |
0.473 |
3 |
0 |
0 |
0.000 |
14 |
17 |
|
[EDO]A:204 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
18 |
8 |
10134 |
95.4 |
2.3 |
0.274 |
4 |
0 |
0 |
0.000 |
15 |
18 |
|
[EDO]B:206 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
18 |
8 |
10243 |
94.2 |
2.7 |
0.277 |
0 |
0 |
0 |
0.000 |
16 |
19 |
|
[EDO]B:210 |
4 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
13 |
7 |
10243 |
93.9 |
3.1 |
0.519 |
3 |
0 |
0 |
0.000 |
17 |
20 |
|
B |
16 |
9 |
10243 |
◊ |
[EDO]A:208 |
-y,x-y-1,z-1/3 |
3_544 |
4 |
1 |
184 |
90.8 |
2.0 |
0.362 |
2 |
0 |
0 |
0.000 |
18 |
21 |
|
[EDO]B:209 |
4 |
1 |
186 |
f |
B |
x-y,x,z-1/6 |
2_554 |
18 |
7 |
10243 |
83.2 |
2.2 |
0.272 |
2 |
0 |
0 |
0.000 |
19 |
22 |
|
A |
19 |
7 |
10134 |
f |
[EDO]A:206 |
x-y,x-1,z-1/6 |
2_544 |
4 |
1 |
184 |
80.6 |
1.6 |
0.750 |
2 |
0 |
0 |
0.000 |
20 |
23 |
|
[EDO]A:211 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
10134 |
77.9 |
1.8 |
0.251 |
1 |
0 |
0 |
0.000 |
21 |
24 |
|
[EDO]B:208 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
12 |
3 |
10243 |
75.7 |
1.2 |
0.633 |
2 |
0 |
0 |
0.000 |
22 |
25 |
|
[EDO]B:204 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
10 |
4 |
10243 |
75.4 |
1.9 |
0.247 |
0 |
0 |
0 |
0.000 |
23 |
26 |
|
[EDO]A:207 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
10134 |
71.7 |
1.4 |
0.742 |
1 |
0 |
0 |
0.000 |
24 |
27 |
|
[PO4]A:202 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
10134 |
71.6 |
-3.5 |
0.905 |
3 |
0 |
0 |
1.000 |
25 |
28 |
|
[EDO]B:207 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
15 |
5 |
10243 |
71.4 |
2.0 |
0.258 |
0 |
0 |
0 |
0.000 |
26 |
29 |
|
[PO4]B:202 |
5 |
1 |
189 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
10243 |
70.3 |
-3.2 |
0.888 |
2 |
0 |
0 |
1.000 |
27 |
30 |
|
B |
8 |
3 |
10243 |
◊ |
A |
x,y,z |
1_555 |
8 |
3 |
10134 |
66.6 |
1.4 |
0.836 |
0 |
0 |
0 |
0.000 |
28 |
31 |
|
[EDO]A:208 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
10134 |
63.2 |
1.1 |
0.639 |
2 |
0 |
0 |
0.000 |
29 |
32 |
|
[EDO]B:209 |
3 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
8 |
5 |
10243 |
62.5 |
2.2 |
0.309 |
2 |
0 |
0 |
0.000 |
30 |
33 |
|
[EDO]A:206 |
3 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
9 |
5 |
10134 |
60.6 |
1.9 |
0.300 |
1 |
0 |
0 |
0.000 |
31 |
34 |
|
B |
8 |
4 |
10243 |
f |
[EDO]A:210 |
-x+1,-y,z-1/2 |
4_654 |
4 |
1 |
184 |
55.0 |
1.7 |
0.928 |
3 |
0 |
0 |
0.000 |
32 |
35 |
|
[EDO]A:210 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
10134 |
54.3 |
1.3 |
0.801 |
0 |
0 |
0 |
0.000 |
33 |
36 |
|
B |
6 |
2 |
10243 |
◊ |
A |
x-y-1,x-1,z-1/6 |
2_444 |
6 |
1 |
10134 |
52.9 |
0.0 |
0.613 |
0 |
0 |
0 |
0.000 |
34 |
37 |
|
[EDO]B:206 |
2 |
1 |
185 |
f |
B |
x-y,x,z-1/6 |
2_554 |
5 |
3 |
10243 |
45.9 |
1.1 |
0.556 |
1 |
0 |
0 |
0.000 |
35 |
38 |
|
A |
5 |
3 |
10134 |
◊ |
[EDO]A:204 |
x-y,x-1,z-1/6 |
2_544 |
2 |
1 |
183 |
42.8 |
1.3 |
0.561 |
1 |
0 |
0 |
0.000 |
36 |
39 |
|
[EDO]A:212 |
2 |
1 |
185 |
f |
[EDO]A:207 |
x,y,z |
1_555 |
1 |
1 |
186 |
28.8 |
1.6 |
0.707 |
0 |
0 |
0 |
0.000 |
37 |
40 |
|
B |
2 |
2 |
10243 |
f |
[EDO]B:208 |
x-y,x,z-1/6 |
2_554 |
2 |
1 |
185 |
28.0 |
0.2 |
0.365 |
0 |
0 |
0 |
0.000 |
38 |
41 |
|
[PO4]B:202 |
3 |
1 |
189 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
10134 |
26.7 |
-1.3 |
0.844 |
0 |
0 |
0 |
0.000 |
39 |
42 |
|
[PO4]A:202 |
2 |
1 |
188 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
10243 |
26.4 |
-1.2 |
0.870 |
0 |
0 |
0 |
0.000 |
40 |
43 |
|
A |
3 |
1 |
10134 |
◊ |
[EDO]A:211 |
x-y,x-1,z-1/6 |
2_544 |
3 |
1 |
185 |
25.8 |
0.9 |
0.886 |
0 |
0 |
0 |
0.000 |
41 |
44 |
|
[EDO]A:213 |
2 |
1 |
184 |
f |
[EDO]A:205 |
x,y,z |
1_555 |
2 |
1 |
185 |
25.6 |
1.0 |
1.000 |
0 |
0 |
0 |
0.000 |
42 |
45 |
|
[EDO]B:204 |
2 |
1 |
184 |
f |
B |
x-y,x,z-1/6 |
2_554 |
3 |
1 |
10243 |
25.6 |
0.9 |
0.889 |
0 |
0 |
0 |
0.000 |
43 |
46 |
|
[PO4]B:202 |
1 |
1 |
189 |
◊ |
[PO4]A:202 |
x,y,z |
1_555 |
1 |
1 |
188 |
5.8 |
-0.6 |
0.800 |
0 |
0 |
0 |
0.000 |
44 |
47 |
|
[EDO]A:211 |
1 |
1 |
185 |
f |
[EDO]A:204 |
x,y,z |
1_555 |
1 |
1 |
183 |
1.4 |
0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
45 |
48 |
|
[EDO]B:210 |
1 |
1 |
187 |
f |
[PO4]B:202 |
x,y,z |
1_555 |
1 |
1 |
189 |
0.5 |
-0.0 |
0.894 |
0 |
0 |
0 |
0.008 |
|