| ## |
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 |
129 |
36 |
22118 |
◊ |
B |
x,y,z |
1_555 |
128 |
43 |
22351 |
1243.6 |
-23.9 |
0.087 |
5 |
0 |
0 |
1.000 |
2 |
|
B |
124 |
34 |
22351 |
◊ |
C |
-y+1,x-y+1,z |
2_665 |
118 |
39 |
22118 |
1107.9 |
-23.9 |
0.082 |
1 |
0 |
0 |
1.000 |
| Average: |
1175.7 |
-23.9 |
0.085 |
3 |
0 |
0 |
1.000 |
| 2 |
3 |
|
A |
113 |
37 |
22529 |
x |
A |
x-y,x,z |
6_555 |
126 |
34 |
22529 |
1143.1 |
-22.6 |
0.071 |
2 |
0 |
0 |
0.456 |
| 3 |
4 |
|
[1Q5]C:1205 |
24 |
1 |
585 |
f |
C |
x,y,z |
1_555 |
74 |
23 |
22118 |
444.6 |
4.8 |
0.517 |
1 |
0 |
0 |
0.000 |
5 |
|
[1Q5]B:1204 |
24 |
1 |
583 |
f |
B |
x,y,z |
1_555 |
69 |
22 |
22351 |
434.2 |
5.2 |
0.514 |
1 |
0 |
0 |
0.000 |
| Average: |
439.4 |
5.0 |
0.515 |
1 |
0 |
0 |
0.000 |
| 4 |
6 |
|
[1Q5]A:1204 |
24 |
1 |
586 |
f |
A |
x,y,z |
1_555 |
65 |
23 |
22529 |
436.5 |
5.4 |
0.492 |
1 |
0 |
0 |
0.000 |
| 5 |
7 |
|
C |
37 |
13 |
22118 |
◊ |
C |
-x,-y+1,z |
4_565 |
37 |
13 |
22118 |
363.9 |
2.3 |
0.944 |
2 |
2 |
0 |
0.000 |
| 6 |
8 |
|
[OLA]C:1203 |
16 |
1 |
490 |
f |
C |
x,y,z |
1_555 |
40 |
14 |
22118 |
324.8 |
2.6 |
0.334 |
0 |
0 |
0 |
0.000 |
| 7 |
9 |
|
[OLA]C:1204 |
19 |
1 |
603 |
◊ |
C |
x,y,z |
1_555 |
45 |
14 |
22118 |
304.1 |
0.2 |
0.313 |
0 |
0 |
0 |
0.000 |
| 8 |
10 |
|
A |
42 |
13 |
22529 |
f |
[OLA]A:1201 |
x-y,x,z |
6_555 |
19 |
1 |
589 |
296.5 |
-1.3 |
0.214 |
0 |
0 |
0 |
0.026 |
| 9 |
11 |
|
[OLA]C:1202 |
20 |
1 |
604 |
f |
C |
x,y,z |
1_555 |
40 |
15 |
22118 |
277.5 |
0.3 |
0.301 |
0 |
0 |
0 |
0.000 |
12 |
|
[OLA]B:1202 |
20 |
1 |
599 |
f |
B |
x,y,z |
1_555 |
38 |
13 |
22351 |
272.6 |
0.4 |
0.283 |
0 |
0 |
0 |
0.000 |
| Average: |
275.0 |
0.3 |
0.292 |
0 |
0 |
0 |
0.000 |
| 10 |
13 |
|
[OLA]C:1201 |
20 |
1 |
597 |
f |
B |
x,y,z |
1_555 |
38 |
13 |
22351 |
258.7 |
-0.8 |
0.194 |
0 |
0 |
0 |
0.021 |
| 11 |
14 |
|
A |
30 |
11 |
22529 |
◊ |
B |
x,y,z-1 |
1_554 |
27 |
11 |
22351 |
244.3 |
-0.0 |
0.677 |
1 |
0 |
0 |
0.000 |
| 12 |
15 |
|
[OLA]B:1203 |
14 |
1 |
467 |
◊ |
B |
x,y,z |
1_555 |
38 |
12 |
22351 |
243.1 |
1.8 |
0.229 |
0 |
0 |
0 |
0.000 |
| 13 |
16 |
|
A |
25 |
10 |
22529 |
f |
[OLA]A:1202 |
x-y,x,z |
6_555 |
18 |
1 |
596 |
223.7 |
-1.7 |
0.124 |
0 |
0 |
0 |
0.033 |
| 14 |
17 |
|
[OLA]A:1202 |
19 |
1 |
596 |
◊ |
A |
x,y,z |
1_555 |
29 |
9 |
22529 |
223.0 |
0.0 |
0.250 |
0 |
0 |
0 |
0.000 |
| 15 |
18 |
|
[OLA]B:1201 |
18 |
1 |
539 |
f |
C |
-y+1,x-y+1,z |
2_665 |
28 |
11 |
22118 |
210.3 |
-1.2 |
0.138 |
0 |
0 |
0 |
0.031 |
| 16 |
19 |
|
C |
23 |
8 |
22118 |
◊ |
B |
x-y,x,z |
6_555 |
24 |
9 |
22351 |
201.6 |
-0.4 |
0.769 |
2 |
1 |
0 |
0.000 |
| 17 |
20 |
|
[OLA]C:1201 |
19 |
1 |
597 |
◊ |
C |
x,y,z |
1_555 |
25 |
9 |
22118 |
196.5 |
-0.2 |
0.204 |
0 |
0 |
0 |
0.005 |
| 18 |
21 |
|
B |
29 |
9 |
22351 |
◊ |
A |
x,y,z |
1_555 |
23 |
6 |
22529 |
194.1 |
-2.2 |
0.614 |
0 |
0 |
0 |
0.000 |
| 19 |
22 |
|
[OLA]B:1201 |
18 |
1 |
539 |
◊ |
B |
x,y,z |
1_555 |
28 |
9 |
22351 |
188.7 |
0.4 |
0.224 |
0 |
0 |
0 |
0.000 |
| 20 |
23 |
|
B |
25 |
9 |
22351 |
f |
[OLA]C:1204 |
-y+1,x-y+1,z |
2_665 |
17 |
1 |
603 |
170.1 |
-1.9 |
0.135 |
0 |
0 |
0 |
0.051 |
| 21 |
24 |
|
[OLA]A:1201 |
14 |
1 |
589 |
◊ |
A |
x,y,z |
1_555 |
23 |
7 |
22529 |
155.1 |
-0.2 |
0.271 |
1 |
0 |
0 |
0.012 |
| 22 |
25 |
|
[OLA]A:1203 |
8 |
1 |
313 |
f |
A |
x,y,z |
1_555 |
25 |
9 |
22529 |
144.8 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.082 |
| 23 |
26 |
|
A |
15 |
3 |
22529 |
x |
A |
x,y,z-1 |
1_554 |
16 |
4 |
22529 |
135.1 |
-1.5 |
0.570 |
1 |
0 |
0 |
0.000 |
| 24 |
27 |
|
C |
13 |
4 |
22118 |
◊ |
A |
x-y,x,z+1 |
6_556 |
12 |
4 |
22529 |
117.5 |
-2.9 |
0.240 |
1 |
0 |
0 |
0.000 |
| 25 |
28 |
|
[OLA]B:1203 |
11 |
1 |
467 |
f |
C |
x,y,z |
1_555 |
18 |
6 |
22118 |
113.5 |
1.6 |
0.226 |
1 |
0 |
0 |
0.000 |
| 26 |
29 |
|
[OLA]C:1202 |
13 |
1 |
604 |
◊ |
B |
x,y,z |
1_555 |
6 |
4 |
22351 |
100.1 |
1.2 |
0.151 |
0 |
0 |
0 |
0.000 |
30 |
|
[OLA]B:1202 |
12 |
1 |
599 |
◊ |
C |
-y+1,x-y+1,z |
2_665 |
6 |
4 |
22118 |
96.8 |
0.9 |
0.146 |
0 |
0 |
0 |
0.000 |
| Average: |
98.5 |
1.1 |
0.149 |
0 |
0 |
0 |
0.000 |
| 27 |
31 |
|
[OLA]C:1202 |
10 |
1 |
604 |
◊ |
[OLA]C:1201 |
x,y,z |
1_555 |
12 |
1 |
597 |
100.0 |
4.4 |
0.344 |
0 |
0 |
0 |
0.000 |
| 28 |
32 |
|
[OLA]B:1202 |
9 |
1 |
599 |
◊ |
[OLA]B:1201 |
x,y,z |
1_555 |
11 |
1 |
539 |
96.7 |
5.2 |
0.411 |
0 |
0 |
0 |
0.000 |
| 29 |
33 |
|
B |
10 |
3 |
22351 |
x |
B |
x,y,z-1 |
1_554 |
13 |
3 |
22351 |
88.5 |
-0.5 |
0.582 |
0 |
0 |
0 |
0.000 |
34 |
|
C |
10 |
4 |
22118 |
x |
C |
x,y,z-1 |
1_554 |
15 |
6 |
22118 |
85.4 |
0.2 |
0.762 |
0 |
0 |
0 |
0.000 |
| Average: |
87.0 |
-0.2 |
0.672 |
0 |
0 |
0 |
0.000 |
| 30 |
35 |
|
[SO4]A:1205 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
22529 |
83.6 |
-12.9 |
0.762 |
2 |
0 |
0 |
0.268 |
| 31 |
36 |
|
[SO4]A:1206 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
22529 |
60.8 |
-8.4 |
0.872 |
2 |
0 |
0 |
0.179 |
| 32 |
37 |
|
[SO4]C:1206 |
5 |
1 |
184 |
f |
B |
x-y,x,z |
6_555 |
7 |
3 |
22351 |
59.5 |
-8.3 |
0.870 |
5 |
0 |
0 |
0.277 |
| 33 |
38 |
|
[OLA]A:1203 |
4 |
1 |
313 |
◊ |
[OLA]A:1202 |
x,y,z |
1_555 |
5 |
1 |
596 |
55.1 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.010 |
| 34 |
39 |
|
C |
9 |
5 |
22118 |
◊ |
[SO4]A:1206 |
x-y,x,z+1 |
6_556 |
4 |
1 |
186 |
52.5 |
-7.0 |
0.857 |
0 |
0 |
0 |
0.000 |
| 35 |
40 |
|
A |
3 |
2 |
22529 |
◊ |
[OLA]A:1203 |
x-y,x,z |
6_555 |
4 |
1 |
313 |
49.9 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.031 |
| 36 |
41 |
|
[SO4]C:1206 |
5 |
1 |
184 |
◊ |
C |
x,y,z |
1_555 |
7 |
3 |
22118 |
47.2 |
-6.5 |
0.894 |
2 |
0 |
0 |
0.000 |
| 37 |
42 |
|
[SO4]C:1206 |
4 |
1 |
184 |
◊ |
A |
x-y,x,z+1 |
6_556 |
6 |
3 |
22529 |
37.8 |
-5.9 |
0.713 |
0 |
0 |
0 |
0.000 |
| 38 |
43 |
|
A |
3 |
1 |
22529 |
◊ |
C |
-y+1,x-y+1,z |
2_665 |
3 |
1 |
22118 |
17.8 |
-0.5 |
0.441 |
0 |
0 |
0 |
0.000 |
| 39 |
44 |
|
[1Q5]C:1205 |
2 |
1 |
585 |
f |
[OLA]C:1203 |
x,y,z |
1_555 |
2 |
1 |
490 |
15.1 |
-0.4 |
0.158 |
0 |
0 |
0 |
0.011 |
|