## |
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 |
301 |
79 |
30796 |
◊ |
A |
x,y,z |
1_555 |
310 |
79 |
30904 |
2913.0 |
-20.4 |
0.187 |
29 |
8 |
0 |
0.151 |
2 |
2 |
|
A |
140 |
42 |
30904 |
◊ |
B |
-y,x-y+1,z+1/3 |
2_565 |
150 |
48 |
30796 |
1256.0 |
2.6 |
0.812 |
10 |
7 |
0 |
0.000 |
3 |
3 |
|
A |
39 |
12 |
30904 |
◊ |
B |
x-y,x,z+1/6 |
6_555 |
42 |
15 |
30796 |
380.2 |
-7.1 |
0.078 |
0 |
1 |
0 |
0.036 |
4 |
4 |
|
[AMP]A:577 |
23 |
1 |
467 |
f |
A |
x,y,z |
1_555 |
49 |
21 |
30904 |
353.6 |
-2.8 |
0.444 |
2 |
0 |
0 |
0.038 |
5 |
|
[AMP]B:577 |
23 |
1 |
463 |
f |
B |
x,y,z |
1_555 |
48 |
21 |
30796 |
346.2 |
-3.2 |
0.380 |
2 |
0 |
0 |
0.038 |
Average: |
349.9 |
-3.0 |
0.412 |
2 |
0 |
0 |
0.038 |
5 |
6 |
|
[BU3]B:583 |
6 |
1 |
222 |
◊ |
B |
x,y,z |
1_555 |
26 |
12 |
30796 |
149.4 |
2.6 |
0.506 |
4 |
0 |
0 |
0.000 |
6 |
7 |
|
[BU3]A:583 |
6 |
1 |
221 |
◊ |
A |
x,y,z |
1_555 |
22 |
11 |
30904 |
148.5 |
2.5 |
0.482 |
2 |
0 |
0 |
0.000 |
7 |
8 |
|
[SO4]A:579 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
20 |
8 |
30904 |
124.9 |
-17.4 |
0.700 |
3 |
0 |
0 |
0.092 |
8 |
9 |
|
[SO4]B:579 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
19 |
8 |
30796 |
115.7 |
-16.6 |
0.725 |
4 |
0 |
0 |
0.090 |
9 |
10 |
|
[SO4]A:585 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
30904 |
96.2 |
-13.9 |
0.588 |
2 |
0 |
0 |
0.073 |
10 |
11 |
|
[SO4]B:584 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
11 |
4 |
30796 |
93.4 |
-10.6 |
0.846 |
2 |
0 |
0 |
0.056 |
11 |
12 |
|
[ACE]A:1 |
3 |
1 |
172 |
cf |
A |
x,y,z |
1_555 |
12 |
5 |
30904 |
92.0 |
-0.9 |
0.669 |
1 |
0 |
0 |
0.007 |
12 |
13 |
|
[SO4]B:578 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
30796 |
89.2 |
-12.8 |
0.850 |
3 |
0 |
0 |
0.069 |
13 |
14 |
|
[SO4]A:584 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
30904 |
86.7 |
-9.3 |
0.927 |
3 |
0 |
0 |
0.052 |
14 |
15 |
|
[SO4]A:578 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
15 |
5 |
30904 |
82.8 |
-11.8 |
0.861 |
5 |
0 |
0 |
0.069 |
15 |
16 |
|
[ACE]B:1 |
3 |
1 |
171 |
cf |
B |
x,y,z |
1_555 |
7 |
4 |
30796 |
80.8 |
-0.7 |
0.732 |
2 |
0 |
0 |
0.008 |
16 |
17 |
|
[SO4]A:582 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
30904 |
79.1 |
-10.3 |
0.822 |
3 |
0 |
0 |
0.057 |
17 |
18 |
|
[SO4]A:586 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
12 |
3 |
30796 |
77.5 |
-9.9 |
0.838 |
3 |
0 |
0 |
0.055 |
18 |
19 |
|
[SO4]A:581 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
30904 |
77.2 |
-9.1 |
0.933 |
2 |
0 |
0 |
0.049 |
19 |
20 |
|
[SO4]B:581 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
6 |
4 |
30796 |
73.3 |
-8.4 |
0.957 |
4 |
0 |
0 |
0.050 |
20 |
21 |
|
[SO4]A:580 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
30904 |
72.0 |
-9.6 |
0.788 |
4 |
0 |
0 |
0.056 |
21 |
22 |
|
[SO4]B:580 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
30796 |
67.6 |
-9.0 |
0.772 |
3 |
0 |
0 |
0.050 |
22 |
23 |
|
[SO4]A:582 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
8 |
3 |
30796 |
63.2 |
-7.5 |
0.885 |
3 |
0 |
0 |
0.039 |
23 |
24 |
|
B |
5 |
2 |
30796 |
◊ |
A |
-y,x-y+1,z-2/3 |
2_564 |
8 |
3 |
30904 |
62.0 |
0.8 |
0.777 |
1 |
1 |
0 |
0.000 |
24 |
25 |
|
[SO4]A:586 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
30904 |
61.7 |
-7.2 |
0.900 |
4 |
0 |
0 |
0.039 |
25 |
26 |
|
[SO4]A:578 |
4 |
1 |
185 |
◊ |
B |
x-y,x,z+1/6 |
6_555 |
4 |
2 |
30796 |
42.9 |
-5.3 |
0.672 |
1 |
0 |
0 |
0.028 |
26 |
27 |
|
A |
3 |
2 |
30904 |
◊ |
[SO4]B:578 |
x-y,x,z+1/6 |
6_555 |
3 |
1 |
186 |
34.5 |
-4.1 |
0.765 |
1 |
0 |
0 |
0.022 |
27 |
28 |
|
[ACE]A:1 |
2 |
1 |
172 |
◊ |
[SO4]B:578 |
x-y,x,z+1/6 |
6_555 |
3 |
1 |
186 |
27.9 |
-4.0 |
0.939 |
0 |
0 |
0 |
0.020 |
28 |
29 |
|
[SO4]A:578 |
1 |
1 |
185 |
◊ |
[ACE]B:1 |
x-y,x,z+1/6 |
6_555 |
2 |
1 |
171 |
23.4 |
-3.3 |
0.843 |
0 |
0 |
0 |
0.016 |
29 |
30 |
|
[ACE]A:1 |
1 |
1 |
172 |
◊ |
B |
x-y,x,z+1/6 |
6_555 |
3 |
1 |
30796 |
19.7 |
-0.4 |
0.583 |
0 |
0 |
0 |
0.002 |
30 |
31 |
|
[BU3]A:583 |
1 |
1 |
221 |
f |
B |
x,y,z |
1_555 |
3 |
1 |
30796 |
19.3 |
-0.1 |
0.401 |
0 |
0 |
0 |
0.001 |
32 |
|
[BU3]B:583 |
2 |
1 |
222 |
f |
A |
x,y,z |
1_555 |
3 |
2 |
30904 |
19.1 |
-0.2 |
0.309 |
0 |
0 |
0 |
0.001 |
Average: |
19.2 |
-0.1 |
0.355 |
0 |
0 |
0 |
0.001 |
31 |
33 |
|
B |
1 |
1 |
30796 |
x |
B |
x-y,x,z+1/6 |
6_555 |
3 |
1 |
30796 |
4.7 |
0.1 |
0.709 |
0 |
0 |
0 |
0.000 |
32 |
34 |
|
[SO4]A:581 |
1 |
1 |
185 |
f |
[SO4]A:578 |
x,y,z |
1_555 |
1 |
1 |
185 |
3.3 |
-0.8 |
1.000 |
0 |
0 |
0 |
0.004 |
33 |
35 |
|
A |
1 |
1 |
30904 |
x |
A |
-y,x-y+1,z+1/3 |
2_565 |
1 |
1 |
30904 |
1.3 |
0.0 |
0.621 |
0 |
0 |
0 |
0.000 |
|