| ## |
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 |
96 |
26 |
17148 |
◊ |
A |
x,y,z |
1_555 |
90 |
24 |
17272 |
884.1 |
-12.5 |
0.087 |
5 |
4 |
0 |
0.223 |
| 2 |
2 |
|
C |
74 |
19 |
17148 |
◊ |
A |
-x-1,y-1/2,-z+1/2 |
3_445 |
68 |
22 |
17272 |
700.3 |
-2.5 |
0.538 |
10 |
0 |
0 |
0.000 |
3 |
|
D |
72 |
19 |
16852 |
◊ |
B |
-x-3/2,-y+1,z-1/2 |
2_364 |
62 |
20 |
17113 |
600.7 |
-0.6 |
0.665 |
9 |
0 |
0 |
0.000 |
| Average: |
650.5 |
-1.5 |
0.601 |
10 |
0 |
0 |
0.000 |
| 3 |
4 |
|
A |
57 |
19 |
17272 |
◊ |
C |
-x-3/2,-y,z-1/2 |
2_354 |
61 |
15 |
17148 |
495.7 |
-2.2 |
0.540 |
7 |
0 |
0 |
0.000 |
5 |
|
D |
55 |
15 |
16852 |
◊ |
B |
-x-2,y-1/2,-z+1/2 |
3_345 |
51 |
17 |
17113 |
469.7 |
-2.6 |
0.474 |
8 |
0 |
0 |
0.000 |
| Average: |
482.7 |
-2.4 |
0.507 |
8 |
0 |
0 |
0.000 |
| 4 |
6 |
|
B |
53 |
18 |
17113 |
◊ |
A |
x,y,z |
1_555 |
57 |
18 |
17272 |
487.9 |
3.9 |
0.898 |
6 |
4 |
0 |
0.000 |
| 5 |
7 |
|
D |
40 |
14 |
16852 |
◊ |
A |
x,y,z |
1_555 |
36 |
14 |
17272 |
450.2 |
-2.2 |
0.454 |
5 |
1 |
1 |
0.000 |
8 |
|
B |
37 |
14 |
17113 |
◊ |
C |
x-1/2,-y+1/2,-z+1 |
4_456 |
42 |
14 |
17148 |
442.9 |
-3.3 |
0.347 |
3 |
0 |
0 |
0.000 |
| Average: |
446.6 |
-2.8 |
0.400 |
4 |
1 |
1 |
0.000 |
| 6 |
9 |
|
D |
49 |
11 |
16852 |
◊ |
C |
-x-3/2,-y,z-1/2 |
2_354 |
49 |
11 |
17148 |
444.6 |
-2.3 |
0.488 |
4 |
0 |
0 |
0.000 |
| 7 |
10 |
|
C |
45 |
14 |
17148 |
◊ |
D |
-x-2,y-1/2,-z+1/2 |
3_345 |
44 |
13 |
16852 |
376.7 |
-2.0 |
0.496 |
3 |
0 |
0 |
0.000 |
| 8 |
11 |
|
[3JD]D:1101 |
24 |
1 |
536 |
f |
D |
x,y,z |
1_555 |
55 |
17 |
16852 |
366.4 |
-6.1 |
0.555 |
4 |
0 |
0 |
0.212 |
12 |
|
[3JD]A:1101 |
24 |
1 |
539 |
f |
A |
x,y,z |
1_555 |
58 |
17 |
17272 |
364.5 |
-6.0 |
0.580 |
3 |
0 |
0 |
0.212 |
13 |
|
[3JD]B:1101 |
24 |
1 |
540 |
f |
B |
x,y,z |
1_555 |
59 |
17 |
17113 |
364.1 |
-6.0 |
0.573 |
3 |
0 |
0 |
0.212 |
14 |
|
[3JD]C:1101 |
24 |
1 |
531 |
f |
C |
x,y,z |
1_555 |
57 |
17 |
17148 |
362.2 |
-5.9 |
0.582 |
3 |
0 |
0 |
0.212 |
| Average: |
364.3 |
-6.0 |
0.573 |
3 |
0 |
0 |
0.212 |
| 9 |
15 |
|
A |
36 |
11 |
17272 |
◊ |
B |
-x-3/2,-y+1,z-1/2 |
2_364 |
36 |
11 |
17113 |
313.1 |
-5.1 |
0.181 |
0 |
0 |
0 |
0.000 |
| 10 |
16 |
|
C |
35 |
11 |
17148 |
◊ |
B |
x,y,z |
1_555 |
22 |
6 |
17113 |
233.0 |
-0.6 |
0.357 |
1 |
0 |
0 |
0.000 |
| 11 |
17 |
|
A |
24 |
7 |
17272 |
◊ |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
22 |
7 |
17113 |
211.6 |
-0.9 |
0.451 |
4 |
1 |
0 |
0.000 |
| 12 |
18 |
|
D |
22 |
8 |
16852 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
20 |
8 |
17272 |
151.2 |
-1.4 |
0.420 |
0 |
0 |
0 |
0.000 |
| 13 |
19 |
|
A |
13 |
5 |
17272 |
◊ |
D |
-x-2,y-1/2,-z+1/2 |
3_345 |
11 |
6 |
16852 |
124.3 |
1.9 |
0.857 |
1 |
4 |
0 |
0.000 |
| 14 |
20 |
|
[GOL]B:1103 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
20 |
10 |
17113 |
117.2 |
-0.5 |
0.496 |
3 |
0 |
0 |
0.021 |
21 |
|
[GOL]C:1103 |
6 |
1 |
219 |
f |
C |
x,y,z |
1_555 |
19 |
9 |
17148 |
115.7 |
-0.5 |
0.501 |
2 |
0 |
0 |
0.021 |
| Average: |
116.5 |
-0.5 |
0.499 |
3 |
0 |
0 |
0.021 |
| 15 |
22 |
|
B |
12 |
3 |
17113 |
x |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
16 |
5 |
17113 |
116.0 |
-0.6 |
0.498 |
2 |
0 |
0 |
0.000 |
| 16 |
23 |
|
[GOL]A:1103 |
6 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
20 |
10 |
17272 |
115.5 |
0.1 |
0.619 |
2 |
0 |
0 |
0.012 |
| 17 |
24 |
|
[SO4]B:1102 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
18 |
8 |
17113 |
101.1 |
-16.2 |
0.715 |
4 |
0 |
0 |
0.064 |
| 18 |
25 |
|
[SO4]A:1102 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
17 |
7 |
17272 |
100.8 |
-15.8 |
0.720 |
4 |
0 |
0 |
0.256 |
| 19 |
26 |
|
[SO4]D:1102 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
17 |
7 |
16852 |
100.2 |
-16.6 |
0.629 |
3 |
0 |
0 |
0.069 |
| 20 |
27 |
|
[SO4]C:1102 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
16 |
7 |
17148 |
99.1 |
-15.6 |
0.721 |
3 |
0 |
0 |
0.247 |
| 21 |
28 |
|
[GOL]C:1103 |
5 |
1 |
219 |
f |
[3JD]C:1101 |
x,y,z |
1_555 |
14 |
1 |
531 |
67.8 |
-0.9 |
0.642 |
0 |
0 |
0 |
0.013 |
29 |
|
[GOL]B:1103 |
5 |
1 |
220 |
f |
[3JD]B:1101 |
x,y,z |
1_555 |
14 |
1 |
540 |
67.2 |
-1.0 |
0.642 |
0 |
0 |
0 |
0.013 |
| Average: |
67.5 |
-0.9 |
0.642 |
0 |
0 |
0 |
0.013 |
| 22 |
30 |
|
[GOL]A:1103 |
6 |
1 |
218 |
f |
[3JD]A:1101 |
x,y,z |
1_555 |
12 |
1 |
539 |
67.1 |
-0.8 |
0.748 |
1 |
0 |
0 |
0.018 |
| 23 |
31 |
|
C |
10 |
5 |
17148 |
◊ |
B |
x,y-1,z |
1_545 |
7 |
3 |
17113 |
64.2 |
-0.7 |
0.441 |
0 |
0 |
0 |
0.000 |
| 24 |
32 |
|
D |
8 |
3 |
16852 |
◊ |
C |
x-1,y,z |
1_455 |
6 |
2 |
17148 |
53.7 |
0.0 |
0.620 |
1 |
0 |
0 |
0.000 |
| 25 |
33 |
|
C |
5 |
2 |
17148 |
◊ |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
6 |
3 |
17113 |
43.0 |
-0.4 |
0.393 |
0 |
0 |
0 |
0.000 |
34 |
|
D |
3 |
1 |
16852 |
◊ |
A |
x-1,y,z |
1_455 |
3 |
1 |
17272 |
26.9 |
-0.2 |
0.449 |
0 |
0 |
0 |
0.000 |
| Average: |
35.0 |
-0.3 |
0.421 |
0 |
0 |
0 |
0.000 |
| 26 |
35 |
|
D |
4 |
2 |
16852 |
◊ |
B |
x,y,z |
1_555 |
7 |
4 |
17113 |
26.9 |
-0.7 |
0.346 |
0 |
0 |
0 |
0.000 |
|