| ## |
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 |
129 |
30 |
9392 |
◊ |
A |
x,y,z |
1_555 |
140 |
32 |
9515 |
1193.8 |
-15.6 |
0.315 |
8 |
4 |
0 |
0.111 |
| 2 |
2 |
|
B |
75 |
26 |
9392 |
◊ |
A |
-x+1,y,-z+2 |
2_657 |
76 |
26 |
9515 |
672.2 |
-4.3 |
0.649 |
3 |
4 |
0 |
0.033 |
| 3 |
3 |
|
B |
42 |
13 |
9392 |
x |
B |
x,y-1,z |
1_545 |
36 |
14 |
9392 |
370.1 |
-3.2 |
0.562 |
0 |
1 |
0 |
0.000 |
| 4 |
4 |
|
[E41]A:401 |
25 |
1 |
584 |
f |
A |
x,y,z |
1_555 |
48 |
16 |
9515 |
333.8 |
-4.3 |
0.365 |
4 |
0 |
0 |
0.069 |
5 |
|
[E41]B:401 |
24 |
1 |
585 |
f |
B |
x,y,z |
1_555 |
45 |
16 |
9392 |
327.8 |
-4.5 |
0.368 |
4 |
0 |
0 |
0.069 |
| Average: |
330.8 |
-4.4 |
0.367 |
4 |
0 |
0 |
0.069 |
| 5 |
6 |
|
A |
24 |
11 |
9515 |
x |
A |
-x+1/2,y-1/2,-z+1 |
4_546 |
28 |
8 |
9515 |
238.2 |
-0.7 |
0.600 |
0 |
0 |
0 |
0.000 |
| 6 |
7 |
|
A |
20 |
9 |
9515 |
x |
A |
x,y-1,z |
1_545 |
21 |
9 |
9515 |
223.6 |
-3.2 |
0.240 |
1 |
0 |
0 |
0.000 |
| 7 |
8 |
|
A |
25 |
10 |
9515 |
◊ |
B |
x-1/2,y+1/2,z |
3_455 |
21 |
7 |
9392 |
188.7 |
-2.2 |
0.491 |
0 |
0 |
0 |
0.000 |
| 8 |
9 |
|
A |
26 |
6 |
9515 |
◊ |
B |
-x+1/2,y-1/2,-z+1 |
4_546 |
16 |
4 |
9392 |
176.3 |
-0.2 |
0.726 |
3 |
1 |
0 |
0.000 |
| 9 |
10 |
|
B |
14 |
6 |
9392 |
x |
B |
-x+3/2,y-1/2,-z+2 |
4_647 |
22 |
6 |
9392 |
168.1 |
-0.7 |
0.663 |
0 |
0 |
0 |
0.000 |
| 10 |
11 |
|
B |
13 |
5 |
9392 |
◊ |
A |
-x+1,y-1,-z+2 |
2_647 |
22 |
9 |
9515 |
156.9 |
-0.5 |
0.671 |
1 |
0 |
0 |
0.000 |
| 11 |
12 |
|
[GOL]B:1272 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
29 |
14 |
9392 |
148.9 |
-0.5 |
0.636 |
4 |
0 |
0 |
0.024 |
13 |
|
[GOL]A:1273 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
24 |
13 |
9515 |
142.0 |
-0.2 |
0.641 |
4 |
0 |
0 |
0.024 |
| Average: |
145.5 |
-0.3 |
0.638 |
4 |
0 |
0 |
0.024 |
| 12 |
14 |
|
[GOL]B:1273 |
5 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
17 |
7 |
9392 |
118.1 |
0.2 |
0.683 |
2 |
0 |
0 |
0.004 |
| 13 |
15 |
|
[GOL]B:1270 |
6 |
1 |
213 |
f |
B |
x,y,z |
1_555 |
14 |
7 |
9392 |
103.1 |
-1.1 |
0.468 |
2 |
0 |
0 |
0.011 |
| 14 |
16 |
|
[GOL]B:1271 |
5 |
1 |
220 |
◊ |
A |
-x+1,y,-z+2 |
2_657 |
14 |
6 |
9515 |
99.2 |
-0.4 |
0.569 |
1 |
0 |
0 |
0.004 |
| 15 |
17 |
|
A |
10 |
3 |
9515 |
◊ |
A |
-x+1,y,-z+2 |
2_657 |
10 |
3 |
9515 |
88.4 |
-1.9 |
0.312 |
0 |
0 |
0 |
0.005 |
| 16 |
18 |
|
[GOL]B:1271 |
5 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
10 |
6 |
9392 |
79.0 |
0.3 |
0.684 |
5 |
0 |
0 |
0.011 |
| 17 |
19 |
|
[GOL]B:1270 |
5 |
1 |
213 |
◊ |
A |
-x+1,y-1,-z+2 |
2_647 |
9 |
5 |
9515 |
68.7 |
0.4 |
0.692 |
2 |
0 |
0 |
0.000 |
| 18 |
20 |
|
B |
5 |
2 |
9392 |
◊ |
B |
-x+1,y,-z+2 |
2_657 |
5 |
2 |
9392 |
62.7 |
-2.0 |
0.121 |
0 |
0 |
0 |
0.005 |
| 19 |
21 |
|
[CA]B:304 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
10 |
8 |
9392 |
45.9 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.135 |
22 |
|
[CA]A:304 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
10 |
8 |
9515 |
45.1 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.135 |
| Average: |
45.5 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.135 |
| 20 |
23 |
|
[CA]A:305 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
12 |
7 |
9515 |
44.9 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.052 |
| 21 |
24 |
|
[CA]B:303 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
6 |
5 |
9392 |
44.3 |
-11.8 |
0.000 |
0 |
0 |
0 |
0.133 |
25 |
|
[CA]A:303 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
5 |
4 |
9515 |
44.2 |
-11.9 |
0.000 |
0 |
0 |
0 |
0.133 |
| Average: |
44.2 |
-11.8 |
0.000 |
0 |
0 |
0 |
0.133 |
| 22 |
26 |
|
[GOL]B:1273 |
3 |
1 |
219 |
f |
[E41]B:401 |
x,y,z |
1_555 |
6 |
1 |
585 |
43.9 |
-1.0 |
0.403 |
0 |
0 |
0 |
0.005 |
| 23 |
27 |
|
[ZN]A:300 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
6 |
4 |
9515 |
36.2 |
-24.5 |
0.000 |
0 |
0 |
0 |
0.274 |
28 |
|
[ZN]B:300 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
6 |
4 |
9392 |
35.9 |
-24.4 |
0.000 |
0 |
0 |
0 |
0.274 |
| Average: |
36.0 |
-24.5 |
0.000 |
0 |
0 |
0 |
0.274 |
| 24 |
29 |
|
[E41]A:401 |
7 |
1 |
584 |
f |
[ZN]A:300 |
x,y,z |
1_555 |
1 |
1 |
98 |
33.9 |
-14.8 |
0.000 |
0 |
0 |
0 |
0.167 |
30 |
|
[E41]B:401 |
7 |
1 |
585 |
f |
[ZN]B:300 |
x,y,z |
1_555 |
1 |
1 |
98 |
33.5 |
-14.9 |
0.000 |
0 |
0 |
0 |
0.167 |
| Average: |
33.7 |
-14.9 |
0.000 |
0 |
0 |
0 |
0.167 |
| 25 |
31 |
|
[GOL]A:1273 |
2 |
1 |
219 |
f |
[E41]A:401 |
x,y,z |
1_555 |
2 |
1 |
584 |
27.1 |
-0.5 |
0.477 |
0 |
0 |
0 |
0.005 |
32 |
|
[GOL]B:1272 |
2 |
1 |
220 |
f |
[E41]B:401 |
x,y,z |
1_555 |
2 |
1 |
585 |
26.7 |
-0.5 |
0.481 |
0 |
0 |
0 |
0.005 |
| Average: |
26.9 |
-0.5 |
0.479 |
0 |
0 |
0 |
0.005 |
| 26 |
33 |
|
A |
3 |
2 |
9515 |
◊ |
[E41]A:401 |
x,y-1,z |
1_545 |
1 |
1 |
584 |
22.6 |
0.5 |
0.580 |
0 |
0 |
0 |
0.000 |
| 27 |
34 |
|
[CA]B:303 |
1 |
1 |
85 |
◊ |
A |
-x+1,y,-z+2 |
2_657 |
1 |
1 |
9515 |
1.2 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
|