## |
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 |
204 |
61 |
15388 |
◊ |
A |
x,y,z |
1_555 |
210 |
61 |
15247 |
1929.7 |
-24.3 |
0.077 |
22 |
8 |
0 |
0.255 |
2 |
2 |
|
B |
116 |
36 |
15388 |
◊ |
A |
y,x,-z |
7_555 |
112 |
35 |
15247 |
1191.3 |
-19.9 |
0.016 |
14 |
4 |
0 |
0.210 |
3 |
3 |
|
B |
64 |
21 |
15388 |
x |
B |
x-1/2,-y+3/2,-z+1/4 |
6_465 |
64 |
17 |
15388 |
559.9 |
-4.5 |
0.374 |
4 |
4 |
0 |
0.000 |
4 |
4 |
|
A |
51 |
15 |
15247 |
◊ |
B |
x,y-1,z |
1_545 |
45 |
14 |
15388 |
456.7 |
-7.2 |
0.145 |
1 |
0 |
0 |
0.000 |
5 |
5 |
|
A |
22 |
6 |
15247 |
◊ |
A |
y,x,-z |
7_555 |
23 |
6 |
15247 |
197.6 |
-0.3 |
0.670 |
0 |
0 |
0 |
0.004 |
6 |
|
B |
22 |
6 |
15388 |
◊ |
B |
y,x,-z |
7_555 |
22 |
6 |
15388 |
188.1 |
-0.6 |
0.640 |
0 |
0 |
0 |
0.004 |
Average: |
192.8 |
-0.4 |
0.655 |
0 |
0 |
0 |
0.004 |
6 |
7 |
|
[PXL]A:1197 |
11 |
1 |
312 |
cf |
A |
x,y,z |
1_555 |
31 |
13 |
15247 |
183.1 |
7.3 |
0.540 |
3 |
0 |
0 |
0.000 |
8 |
|
[PXL]B:1197 |
11 |
1 |
312 |
cf |
B |
x,y,z |
1_555 |
31 |
13 |
15388 |
182.6 |
7.3 |
0.567 |
3 |
0 |
0 |
0.000 |
Average: |
182.9 |
7.3 |
0.554 |
3 |
0 |
0 |
0.000 |
7 |
9 |
|
[GOL]B:956 |
6 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
23 |
8 |
15388 |
132.0 |
-1.4 |
0.428 |
0 |
0 |
0 |
0.022 |
8 |
10 |
|
[GOL]B:960 |
6 |
1 |
221 |
f |
B |
x,y,z |
1_555 |
19 |
7 |
15388 |
131.1 |
-0.2 |
0.562 |
2 |
0 |
0 |
0.016 |
9 |
11 |
|
[GOL]A:955 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
23 |
9 |
15247 |
127.9 |
-1.5 |
0.459 |
0 |
0 |
0 |
0.028 |
10 |
12 |
|
[SO4]A:1601 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
18 |
10 |
15247 |
103.2 |
-13.8 |
0.798 |
5 |
0 |
0 |
0.309 |
11 |
13 |
|
[SO4]B:2601 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
19 |
10 |
15388 |
100.8 |
-12.4 |
0.803 |
4 |
0 |
0 |
0.222 |
12 |
14 |
|
[GOL]A:958 |
6 |
1 |
217 |
◊ |
A |
x,y,z |
1_555 |
17 |
7 |
15247 |
100.7 |
-0.2 |
0.608 |
3 |
0 |
0 |
0.022 |
15 |
|
[GOL]B:957 |
6 |
1 |
218 |
◊ |
B |
x,y,z |
1_555 |
15 |
7 |
15388 |
98.6 |
-0.1 |
0.617 |
3 |
0 |
0 |
0.022 |
Average: |
99.7 |
-0.2 |
0.613 |
3 |
0 |
0 |
0.022 |
13 |
16 |
|
[SO4]A:1603 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
15 |
5 |
15247 |
89.6 |
-12.6 |
0.903 |
3 |
0 |
0 |
0.269 |
14 |
17 |
|
[SO4]B:2604 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
15388 |
81.4 |
-11.2 |
0.877 |
3 |
0 |
0 |
0.196 |
15 |
18 |
|
[GOL]B:954 |
5 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
15388 |
77.7 |
-0.4 |
0.492 |
3 |
0 |
0 |
0.027 |
16 |
19 |
|
[SO4]A:1605 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
15247 |
74.6 |
-10.3 |
0.854 |
1 |
0 |
0 |
0.208 |
17 |
20 |
|
[SO4]B:2602 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
11 |
3 |
15388 |
74.2 |
-11.1 |
0.740 |
4 |
0 |
0 |
0.202 |
18 |
21 |
|
[GOL]A:953 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
15247 |
73.7 |
-0.9 |
0.389 |
2 |
0 |
0 |
0.035 |
19 |
22 |
|
[SO4]B:2605 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
9 |
3 |
15388 |
70.2 |
-9.7 |
0.867 |
3 |
0 |
0 |
0.173 |
20 |
23 |
|
[SO4]B:2605 |
5 |
1 |
185 |
◊ |
B |
y,x,-z |
7_555 |
9 |
3 |
15388 |
63.6 |
-8.6 |
0.739 |
2 |
0 |
0 |
0.148 |
21 |
24 |
|
[SO4]A:1605 |
5 |
1 |
185 |
◊ |
A |
y,x,-z |
7_555 |
9 |
3 |
15247 |
63.4 |
-8.3 |
0.735 |
1 |
0 |
0 |
0.170 |
22 |
25 |
|
[GOL]B:957 |
5 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
15247 |
58.0 |
-0.1 |
0.590 |
0 |
0 |
0 |
0.002 |
26 |
|
[GOL]A:958 |
5 |
1 |
217 |
f |
B |
x,y,z |
1_555 |
8 |
3 |
15388 |
54.9 |
-0.1 |
0.582 |
0 |
0 |
0 |
0.002 |
Average: |
56.4 |
-0.1 |
0.586 |
0 |
0 |
0 |
0.002 |
23 |
27 |
|
A |
5 |
3 |
15247 |
x |
A |
x-1/2,-y+1/2,-z+1/4 |
6_455 |
10 |
4 |
15247 |
52.7 |
-1.0 |
0.333 |
0 |
0 |
0 |
0.000 |
24 |
28 |
|
[GOL]B:957 |
4 |
1 |
218 |
f |
[SO4]A:1601 |
x,y,z |
1_555 |
4 |
1 |
185 |
29.8 |
-2.9 |
0.803 |
1 |
0 |
0 |
0.066 |
25 |
29 |
|
[GOL]A:958 |
4 |
1 |
217 |
f |
[SO4]B:2601 |
x,y,z |
1_555 |
4 |
1 |
186 |
29.7 |
-3.0 |
0.803 |
1 |
0 |
0 |
0.054 |
26 |
30 |
|
[GOL]A:955 |
3 |
1 |
219 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
15388 |
26.0 |
-0.2 |
0.319 |
0 |
0 |
0 |
0.002 |
27 |
31 |
|
[SO4]B:2605 |
5 |
1 |
185 |
◊ |
A |
y,x,-z |
7_555 |
3 |
2 |
15247 |
23.8 |
-2.0 |
0.935 |
0 |
0 |
0 |
0.016 |
28 |
32 |
|
[PXL]B:1197 |
4 |
1 |
312 |
f |
[SO4]B:2601 |
x,y,z |
1_555 |
3 |
1 |
186 |
22.1 |
-1.7 |
0.226 |
0 |
0 |
0 |
0.027 |
29 |
33 |
|
[GOL]B:956 |
2 |
1 |
219 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
15247 |
21.4 |
-0.2 |
0.442 |
0 |
0 |
0 |
0.001 |
30 |
34 |
|
[SO4]B:2601 |
3 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
4 |
3 |
15247 |
20.2 |
-2.2 |
0.829 |
0 |
0 |
0 |
0.016 |
31 |
35 |
|
[SO4]A:1605 |
4 |
1 |
185 |
◊ |
B |
y,x,-z |
7_555 |
2 |
1 |
15388 |
20.1 |
-1.7 |
0.932 |
0 |
0 |
0 |
0.013 |
32 |
36 |
|
[PXL]A:1197 |
4 |
1 |
312 |
f |
[SO4]A:1601 |
x,y,z |
1_555 |
3 |
1 |
185 |
18.8 |
-1.3 |
0.141 |
0 |
0 |
0 |
0.026 |
33 |
37 |
|
[PXL]A:1197 |
3 |
1 |
312 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
15388 |
12.9 |
0.4 |
0.160 |
0 |
0 |
0 |
0.000 |
38 |
|
[PXL]B:1197 |
3 |
1 |
312 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
15247 |
9.8 |
0.3 |
0.075 |
0 |
0 |
0 |
0.000 |
Average: |
11.3 |
0.4 |
0.117 |
0 |
0 |
0 |
0.000 |
34 |
39 |
|
[SO4]A:1601 |
2 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
15388 |
11.8 |
-1.4 |
0.729 |
0 |
0 |
0 |
0.010 |
35 |
40 |
|
[GOL]B:960 |
1 |
1 |
221 |
◊ |
A |
y,x,-z |
7_555 |
1 |
1 |
15247 |
10.9 |
0.2 |
0.656 |
0 |
0 |
0 |
0.000 |
36 |
41 |
|
[GOL]B:960 |
1 |
1 |
221 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
15247 |
3.9 |
-0.0 |
0.409 |
0 |
0 |
0 |
0.000 |
|