## |
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 |
45 |
13 |
5324 |
◊ |
B |
x,y,z |
1_555 |
49 |
13 |
5521 |
435.6 |
-5.4 |
0.228 |
2 |
0 |
0 |
0.067 |
2 |
2 |
|
[HUE]B:201 |
34 |
1 |
819 |
f |
B |
x,y,z |
1_555 |
52 |
16 |
5521 |
433.6 |
-17.0 |
0.209 |
1 |
0 |
0 |
0.361 |
3 |
|
[HUE]C:201 |
32 |
1 |
796 |
f |
C |
x,y,z |
1_555 |
49 |
16 |
5324 |
419.2 |
-15.8 |
0.288 |
1 |
0 |
0 |
0.361 |
4 |
|
[HUE]D:201 |
33 |
1 |
792 |
f |
D |
x,y,z |
1_555 |
50 |
14 |
5442 |
408.1 |
-15.5 |
0.265 |
1 |
0 |
0 |
0.361 |
5 |
|
[HUE]A:201 |
33 |
1 |
794 |
f |
A |
x,y,z |
1_555 |
48 |
15 |
5388 |
407.6 |
-15.8 |
0.265 |
1 |
0 |
0 |
0.361 |
Average: |
417.1 |
-16.0 |
0.257 |
1 |
0 |
0 |
0.361 |
3 |
6 |
|
B |
40 |
12 |
5521 |
◊ |
A |
x,y,z |
1_555 |
34 |
8 |
5388 |
351.2 |
2.0 |
0.779 |
10 |
0 |
0 |
0.000 |
4 |
7 |
|
D |
36 |
10 |
5442 |
◊ |
C |
x,y,z |
1_555 |
38 |
8 |
5324 |
327.4 |
-0.8 |
0.575 |
6 |
2 |
0 |
0.000 |
8 |
|
B |
39 |
9 |
5521 |
◊ |
A |
-x+1/2,y-1/2,-z+1 |
4_546 |
38 |
11 |
5388 |
318.9 |
-0.9 |
0.526 |
5 |
1 |
0 |
0.000 |
9 |
|
C |
36 |
11 |
5324 |
◊ |
A |
-x+1/2,y-1/2,-z |
4_545 |
36 |
9 |
5388 |
303.7 |
-1.4 |
0.499 |
5 |
0 |
0 |
0.000 |
10 |
|
B |
30 |
9 |
5521 |
◊ |
D |
x-1/2,y+1/2,z |
3_455 |
32 |
7 |
5442 |
293.0 |
-1.5 |
0.495 |
5 |
2 |
0 |
0.000 |
Average: |
310.7 |
-1.1 |
0.524 |
5 |
1 |
0 |
0.000 |
5 |
11 |
|
D |
26 |
10 |
5442 |
◊ |
D |
-x+1,y,-z+1 |
2_656 |
26 |
10 |
5442 |
248.6 |
-3.9 |
0.231 |
2 |
0 |
0 |
0.032 |
6 |
12 |
|
[O4B]B:202 |
16 |
1 |
465 |
f |
B |
x,y,z |
1_555 |
15 |
5 |
5521 |
155.5 |
-2.1 |
0.776 |
5 |
0 |
0 |
0.060 |
13 |
|
[O4B]A:202 |
18 |
1 |
469 |
f |
A |
x,y,z |
1_555 |
15 |
4 |
5388 |
149.7 |
-2.0 |
0.765 |
6 |
0 |
0 |
0.060 |
14 |
|
[O4B]D:202 |
17 |
1 |
462 |
f |
D |
x,y,z |
1_555 |
16 |
4 |
5442 |
148.9 |
-1.9 |
0.802 |
6 |
0 |
0 |
0.060 |
Average: |
151.4 |
-2.0 |
0.781 |
6 |
0 |
0 |
0.060 |
7 |
15 |
|
[O4B]B:203 |
15 |
1 |
465 |
f |
B |
x,y,z |
1_555 |
24 |
7 |
5521 |
155.5 |
-3.0 |
0.695 |
0 |
0 |
0 |
0.032 |
8 |
16 |
|
[O4B]C:202 |
17 |
1 |
466 |
f |
C |
x,y,z |
1_555 |
15 |
4 |
5324 |
150.7 |
-1.9 |
0.777 |
6 |
0 |
0 |
0.048 |
9 |
17 |
|
B |
19 |
7 |
5521 |
◊ |
[O4B]A:202 |
-x+1/2,y-1/2,-z+1 |
4_546 |
9 |
1 |
469 |
121.6 |
-2.6 |
0.678 |
0 |
0 |
0 |
0.000 |
18 |
|
[O4B]B:202 |
8 |
1 |
465 |
◊ |
D |
x-1/2,y+1/2,z |
3_455 |
21 |
7 |
5442 |
121.0 |
-2.6 |
0.654 |
0 |
0 |
0 |
0.000 |
19 |
|
[O4B]D:202 |
8 |
1 |
462 |
◊ |
C |
x,y,z |
1_555 |
19 |
7 |
5324 |
120.9 |
-2.4 |
0.662 |
0 |
0 |
0 |
0.000 |
Average: |
121.2 |
-2.5 |
0.665 |
0 |
0 |
0 |
0.000 |
10 |
20 |
|
[O4B]C:202 |
8 |
1 |
466 |
◊ |
A |
-x+1/2,y-1/2,-z |
4_545 |
19 |
7 |
5388 |
118.8 |
-2.5 |
0.637 |
0 |
0 |
0 |
0.000 |
11 |
21 |
|
[HUE]B:201 |
11 |
1 |
819 |
◊ |
C |
x,y,z |
1_555 |
16 |
3 |
5324 |
109.5 |
-4.5 |
0.323 |
0 |
0 |
0 |
0.049 |
12 |
22 |
|
[HUE]A:201 |
8 |
1 |
794 |
◊ |
B |
x,y,z |
1_555 |
18 |
5 |
5521 |
99.1 |
-2.0 |
0.526 |
0 |
0 |
0 |
0.000 |
13 |
23 |
|
[SO4]D:204 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
15 |
7 |
5442 |
97.2 |
-14.8 |
0.770 |
3 |
0 |
0 |
0.214 |
14 |
24 |
|
[O4B]B:203 |
10 |
1 |
465 |
◊ |
D |
x-1/2,y+1/2,z |
3_455 |
12 |
5 |
5442 |
94.6 |
-2.7 |
0.474 |
0 |
0 |
0 |
0.000 |
15 |
25 |
|
[SO4]A:203 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
17 |
7 |
5388 |
93.4 |
-13.5 |
0.748 |
3 |
0 |
0 |
0.038 |
16 |
26 |
|
[SO4]B:204 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
11 |
4 |
5521 |
92.8 |
-13.2 |
0.827 |
5 |
0 |
0 |
0.165 |
17 |
27 |
|
[HUE]D:201 |
8 |
1 |
792 |
◊ |
D |
-x+1,y,-z+1 |
2_656 |
11 |
6 |
5442 |
88.7 |
-1.9 |
0.548 |
0 |
0 |
0 |
0.025 |
18 |
28 |
|
[HUE]C:201 |
9 |
1 |
796 |
◊ |
B |
x,y,z |
1_555 |
10 |
3 |
5521 |
81.6 |
-3.5 |
0.362 |
0 |
0 |
0 |
0.038 |
19 |
29 |
|
[GOL]B:205 |
6 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
5521 |
79.1 |
-0.8 |
0.429 |
2 |
0 |
0 |
0.018 |
20 |
30 |
|
[SO4]D:205 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
11 |
4 |
5442 |
74.4 |
-11.2 |
0.613 |
3 |
0 |
0 |
0.166 |
21 |
31 |
|
[SO4]C:203 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
9 |
4 |
5324 |
72.1 |
-10.5 |
0.607 |
3 |
0 |
0 |
0.127 |
22 |
32 |
|
[SO4]D:203 |
4 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
9 |
4 |
5442 |
71.6 |
-10.2 |
0.851 |
4 |
0 |
0 |
0.160 |
23 |
33 |
|
[SO4]D:203 |
4 |
1 |
186 |
◊ |
[HUE]D:201 |
-x+1,y,-z+1 |
2_656 |
7 |
1 |
792 |
52.6 |
-7.6 |
0.840 |
0 |
0 |
0 |
0.101 |
24 |
34 |
|
D |
6 |
3 |
5442 |
◊ |
C |
-x+1,y,-z+1 |
2_656 |
7 |
2 |
5324 |
51.4 |
0.9 |
0.773 |
0 |
0 |
0 |
0.000 |
25 |
35 |
|
[GOL]B:205 |
4 |
1 |
219 |
◊ |
D |
x-1/2,y+1/2,z |
3_455 |
3 |
1 |
5442 |
40.1 |
1.3 |
0.801 |
2 |
0 |
0 |
0.000 |
26 |
36 |
|
[O4B]B:203 |
5 |
1 |
465 |
◊ |
A |
x,y,z |
1_555 |
4 |
1 |
5388 |
35.4 |
-0.9 |
0.562 |
0 |
0 |
0 |
0.000 |
27 |
37 |
|
[SO4]B:204 |
4 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
5 |
1 |
5324 |
34.8 |
-4.2 |
0.810 |
1 |
0 |
0 |
0.050 |
28 |
38 |
|
[SO4]D:205 |
4 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
5324 |
26.2 |
-2.6 |
0.956 |
2 |
0 |
0 |
0.000 |
29 |
39 |
|
[SO4]C:203 |
2 |
1 |
185 |
◊ |
A |
-x+1/2,y-1/2,-z |
4_545 |
3 |
1 |
5388 |
22.6 |
-2.4 |
0.910 |
1 |
0 |
0 |
0.000 |
30 |
40 |
|
[SO4]A:203 |
4 |
1 |
185 |
f |
[O4B]A:202 |
x,y,z |
1_555 |
3 |
1 |
469 |
20.7 |
-2.7 |
0.981 |
0 |
0 |
0 |
0.007 |
31 |
41 |
|
[SO4]D:204 |
2 |
1 |
185 |
f |
[O4B]D:202 |
x,y,z |
1_555 |
3 |
1 |
462 |
16.5 |
-2.3 |
0.961 |
0 |
0 |
0 |
0.031 |
32 |
42 |
|
[SO4]B:204 |
1 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
5388 |
12.3 |
-1.6 |
0.732 |
0 |
0 |
0 |
0.000 |
33 |
43 |
|
[SO4]D:204 |
2 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
2 |
2 |
5324 |
8.8 |
-0.9 |
0.852 |
0 |
0 |
0 |
0.000 |
34 |
44 |
|
[GOL]B:205 |
1 |
1 |
219 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
5388 |
5.4 |
0.1 |
0.593 |
0 |
0 |
0 |
0.000 |
35 |
45 |
|
[HUE]C:201 |
1 |
1 |
796 |
◊ |
A |
-x+1/2,y-1/2,-z+1 |
4_546 |
1 |
1 |
5388 |
3.4 |
-0.0 |
0.788 |
0 |
0 |
0 |
0.000 |
|