## |
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 |
|
L |
111 |
22 |
3334 |
◊ |
B |
x,y,z |
1_555 |
135 |
40 |
17947 |
1182.1 |
-11.0 |
0.447 |
13 |
8 |
0 |
1.000 |
2 |
2 |
|
B |
103 |
25 |
17947 |
◊ |
A |
x-y,x,z+1/6 |
6_555 |
100 |
25 |
17951 |
920.2 |
-2.6 |
0.545 |
12 |
0 |
0 |
0.000 |
3 |
3 |
|
L |
80 |
19 |
3334 |
◊ |
A |
x,y,z |
1_555 |
91 |
32 |
17951 |
878.1 |
-8.6 |
0.334 |
11 |
8 |
0 |
1.000 |
4 |
4 |
|
B |
61 |
18 |
17947 |
◊ |
A |
x-y,x-1,z+1/6 |
6_545 |
58 |
17 |
17951 |
558.8 |
-7.6 |
0.107 |
0 |
0 |
0 |
0.000 |
5 |
5 |
|
B |
53 |
13 |
17947 |
◊ |
A |
x,y,z |
1_555 |
55 |
13 |
17951 |
517.8 |
-9.6 |
0.032 |
4 |
7 |
0 |
0.283 |
6 |
6 |
|
[NAG]D:1 |
12 |
1 |
360 |
cf |
A |
x,y,z |
1_555 |
23 |
7 |
17951 |
165.9 |
3.4 |
0.378 |
0 |
0 |
0 |
0.000 |
7 |
|
[NAG]F:1 |
12 |
1 |
359 |
cf |
B |
x,y,z |
1_555 |
23 |
7 |
17947 |
164.9 |
3.4 |
0.379 |
1 |
0 |
0 |
0.000 |
Average: |
165.4 |
3.4 |
0.378 |
1 |
0 |
0 |
0.000 |
7 |
8 |
|
[NAG]E:1 |
13 |
1 |
364 |
cf |
B |
x,y,z |
1_555 |
16 |
8 |
17947 |
139.6 |
2.8 |
0.252 |
1 |
0 |
0 |
0.000 |
9 |
|
[NAG]C:1 |
13 |
1 |
362 |
cf |
A |
x,y,z |
1_555 |
15 |
8 |
17951 |
137.1 |
2.7 |
0.261 |
1 |
0 |
0 |
0.000 |
Average: |
138.4 |
2.7 |
0.256 |
1 |
0 |
0 |
0.000 |
8 |
10 |
|
[NAG]D:2 |
9 |
1 |
361 |
cf |
[NAG]D:1 |
x,y,z |
1_555 |
7 |
1 |
360 |
77.9 |
2.0 |
0.104 |
2 |
0 |
0 |
0.000 |
11 |
|
[NAG]F:2 |
9 |
1 |
363 |
cf |
[NAG]F:1 |
x,y,z |
1_555 |
7 |
1 |
359 |
77.1 |
1.9 |
0.103 |
2 |
0 |
0 |
0.000 |
Average: |
77.5 |
2.0 |
0.103 |
2 |
0 |
0 |
0.000 |
9 |
12 |
|
[NAG]D:2 |
9 |
1 |
361 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
17951 |
70.4 |
0.8 |
0.184 |
1 |
0 |
0 |
0.000 |
13 |
|
[NAG]F:2 |
9 |
1 |
363 |
f |
B |
x,y,z |
1_555 |
11 |
6 |
17947 |
67.0 |
0.6 |
0.179 |
1 |
0 |
0 |
0.000 |
Average: |
68.7 |
0.7 |
0.182 |
1 |
0 |
0 |
0.000 |
10 |
14 |
|
[NAG]E:2 |
9 |
1 |
361 |
cf |
[NAG]E:1 |
x,y,z |
1_555 |
7 |
1 |
364 |
67.1 |
1.2 |
0.061 |
0 |
0 |
0 |
0.000 |
15 |
|
[NAG]C:2 |
9 |
1 |
360 |
cf |
[NAG]C:1 |
x,y,z |
1_555 |
8 |
1 |
362 |
66.9 |
1.2 |
0.058 |
0 |
0 |
0 |
0.000 |
Average: |
67.0 |
1.2 |
0.059 |
0 |
0 |
0 |
0.000 |
11 |
16 |
|
[CL]B:508 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
10 |
8 |
17947 |
64.8 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.905 |
17 |
|
[CL]A:508 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
7 |
17951 |
64.1 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.905 |
Average: |
64.5 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.905 |
12 |
18 |
|
[MAN]D:4 |
7 |
1 |
294 |
cf |
[MAN]D:3 |
x,y,z |
1_555 |
6 |
1 |
291 |
63.8 |
2.7 |
0.217 |
0 |
0 |
0 |
0.000 |
19 |
|
[MAN]F:4 |
6 |
1 |
295 |
cf |
[MAN]F:3 |
x,y,z |
1_555 |
5 |
1 |
292 |
62.2 |
2.7 |
0.302 |
0 |
0 |
0 |
0.000 |
Average: |
63.0 |
2.7 |
0.260 |
0 |
0 |
0 |
0.000 |
13 |
20 |
|
[MAN]D:3 |
5 |
1 |
291 |
cf |
[NAG]D:2 |
x,y,z |
1_555 |
5 |
1 |
361 |
59.3 |
0.8 |
0.118 |
0 |
0 |
0 |
0.000 |
21 |
|
[MAN]F:3 |
6 |
1 |
292 |
cf |
[NAG]F:2 |
x,y,z |
1_555 |
5 |
1 |
363 |
58.4 |
0.8 |
0.109 |
0 |
0 |
0 |
0.000 |
Average: |
58.9 |
0.8 |
0.114 |
0 |
0 |
0 |
0.000 |
14 |
22 |
|
[MAN]E:3 |
5 |
1 |
292 |
cf |
[NAG]E:2 |
x,y,z |
1_555 |
7 |
1 |
361 |
58.4 |
1.4 |
0.108 |
0 |
0 |
0 |
0.000 |
23 |
|
[MAN]C:3 |
5 |
1 |
291 |
cf |
[NAG]C:2 |
x,y,z |
1_555 |
6 |
1 |
360 |
57.9 |
1.4 |
0.127 |
0 |
0 |
0 |
0.000 |
Average: |
58.1 |
1.4 |
0.117 |
0 |
0 |
0 |
0.000 |
15 |
24 |
|
[NAG]E:2 |
8 |
1 |
361 |
f |
B |
x,y,z |
1_555 |
7 |
4 |
17947 |
57.4 |
0.3 |
0.133 |
0 |
0 |
0 |
0.000 |
25 |
|
[NAG]C:2 |
7 |
1 |
360 |
f |
A |
x,y,z |
1_555 |
5 |
3 |
17951 |
50.1 |
0.2 |
0.134 |
0 |
0 |
0 |
0.000 |
Average: |
53.7 |
0.3 |
0.133 |
0 |
0 |
0 |
0.000 |
16 |
26 |
|
[MAN]E:3 |
5 |
1 |
292 |
f |
B |
x,y,z |
1_555 |
4 |
2 |
17947 |
12.5 |
-0.3 |
0.202 |
0 |
0 |
0 |
0.020 |
27 |
|
[MAN]C:3 |
3 |
1 |
291 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
17951 |
7.1 |
-0.3 |
0.188 |
0 |
0 |
0 |
0.020 |
Average: |
9.8 |
-0.3 |
0.195 |
0 |
0 |
0 |
0.020 |
17 |
28 |
|
A |
1 |
1 |
17951 |
x |
A |
x-y,x,z+1/6 |
6_555 |
2 |
1 |
17951 |
9.1 |
0.2 |
0.788 |
0 |
0 |
0 |
0.000 |
29 |
|
B |
2 |
1 |
17947 |
x |
B |
x-y,x,z+1/6 |
6_555 |
1 |
1 |
17947 |
8.7 |
0.2 |
0.792 |
0 |
0 |
0 |
0.000 |
Average: |
8.9 |
0.2 |
0.790 |
0 |
0 |
0 |
0.000 |
18 |
30 |
|
[MAN]D:4 |
1 |
1 |
294 |
f |
[NAG]D:2 |
x,y,z |
1_555 |
2 |
1 |
361 |
6.4 |
0.2 |
0.193 |
0 |
0 |
0 |
0.000 |
31 |
|
[MAN]F:4 |
2 |
1 |
295 |
f |
[NAG]F:2 |
x,y,z |
1_555 |
2 |
1 |
363 |
4.6 |
0.2 |
0.232 |
0 |
0 |
0 |
0.000 |
Average: |
5.5 |
0.2 |
0.212 |
0 |
0 |
0 |
0.000 |
|