| ## |
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 |
111 |
32 |
13390 |
x |
B |
-y+1/2,x+1/2,z |
3_555 |
111 |
32 |
13390 |
1064.3 |
-7.1 |
0.124 |
17 |
7 |
0 |
0.399 |
2 |
|
A |
113 |
32 |
13382 |
x |
A |
-y+1/2,x-1/2,z |
3_545 |
108 |
32 |
13382 |
1049.7 |
-7.1 |
0.123 |
14 |
6 |
0 |
0.399 |
| Average: |
1057.0 |
-7.1 |
0.123 |
16 |
7 |
0 |
0.399 |
| 2 |
3 |
|
B |
37 |
8 |
13390 |
◊ |
A |
x-1/2,-y+1/2,-z |
6_455 |
38 |
8 |
13382 |
367.3 |
-0.4 |
0.483 |
8 |
4 |
0 |
0.048 |
| 3 |
4 |
|
B |
26 |
9 |
13390 |
◊ |
A |
x,y,z |
1_555 |
27 |
7 |
13382 |
200.5 |
-2.1 |
0.232 |
2 |
0 |
0 |
0.000 |
| 4 |
5 |
|
[GOL]B:338 |
6 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
28 |
11 |
13390 |
135.0 |
-1.4 |
0.282 |
3 |
0 |
0 |
0.070 |
| 5 |
6 |
|
[GOL]A:341 |
6 |
1 |
217 |
f |
A |
x,y,z |
1_555 |
22 |
11 |
13382 |
134.1 |
0.0 |
0.572 |
5 |
0 |
0 |
0.045 |
| 6 |
7 |
|
[GOL]B:339 |
6 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
23 |
11 |
13390 |
133.3 |
0.0 |
0.570 |
4 |
0 |
0 |
0.045 |
| 7 |
8 |
|
[GOL]A:340 |
6 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
30 |
11 |
13382 |
133.2 |
-0.6 |
0.467 |
3 |
0 |
0 |
0.039 |
| 8 |
9 |
|
[GOL]A:343 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
14 |
7 |
13382 |
114.4 |
0.0 |
0.570 |
3 |
0 |
0 |
0.027 |
| 9 |
10 |
|
[GOL]A:342 |
6 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
13382 |
104.1 |
1.5 |
0.744 |
7 |
0 |
0 |
0.033 |
11 |
|
[GOL]B:340 |
6 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
14 |
6 |
13390 |
102.6 |
1.7 |
0.799 |
6 |
0 |
0 |
0.033 |
| Average: |
103.3 |
1.6 |
0.771 |
7 |
0 |
0 |
0.033 |
| 10 |
12 |
|
[GOL]A:345 |
5 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
13382 |
90.5 |
0.4 |
0.612 |
3 |
0 |
0 |
0.019 |
| 11 |
13 |
|
[CL]A:344 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
13382 |
58.1 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.171 |
| 12 |
14 |
|
[CL]B:341 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
13390 |
50.9 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.152 |
15 |
|
[CL]A:339 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
13382 |
48.5 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.152 |
| Average: |
49.7 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.152 |
| 13 |
16 |
|
[MG]B:337 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
13390 |
47.3 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.157 |
17 |
|
[MG]A:337 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
13382 |
47.3 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.157 |
| Average: |
47.3 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.157 |
| 14 |
18 |
|
A |
6 |
2 |
13382 |
◊ |
[CL]A:339 |
-y+1/2,x-1/2,z |
3_545 |
1 |
1 |
125 |
41.5 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.138 |
19 |
|
B |
6 |
2 |
13390 |
◊ |
[CL]B:341 |
-y+1/2,x+1/2,z |
3_555 |
1 |
1 |
125 |
41.2 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.138 |
| Average: |
41.3 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.138 |
| 15 |
20 |
|
[GOL]B:339 |
5 |
1 |
216 |
f |
[GOL]B:338 |
x,y,z |
1_555 |
4 |
1 |
219 |
40.7 |
0.0 |
0.562 |
1 |
0 |
0 |
0.011 |
| 16 |
21 |
|
[GOL]A:341 |
4 |
1 |
217 |
f |
[GOL]A:340 |
x,y,z |
1_555 |
4 |
1 |
216 |
40.3 |
-0.1 |
0.556 |
1 |
0 |
0 |
0.011 |
| 17 |
22 |
|
[CL]A:344 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
13390 |
25.4 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.000 |
| 18 |
23 |
|
[MG]A:337 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
7 |
4 |
13390 |
22.9 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.000 |
| 19 |
24 |
|
[MG]A:338 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
13382 |
22.7 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.046 |
25 |
|
[MG]A:338 |
1 |
1 |
98 |
◊ |
B |
y,x,-z |
7_555 |
4 |
2 |
13390 |
22.4 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.046 |
| Average: |
22.6 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.046 |
| 20 |
26 |
|
A |
2 |
1 |
13382 |
◊ |
A |
-x+1,-y,z |
2_655 |
2 |
1 |
13382 |
10.9 |
-0.3 |
0.291 |
0 |
0 |
0 |
0.004 |
27 |
|
B |
2 |
1 |
13390 |
◊ |
B |
-x,-y+1,z |
2_565 |
2 |
1 |
13390 |
10.3 |
-0.3 |
0.298 |
0 |
0 |
0 |
0.004 |
| Average: |
10.6 |
-0.3 |
0.294 |
0 |
0 |
0 |
0.004 |
| 21 |
28 |
|
B |
1 |
1 |
13390 |
◊ |
[MG]A:338 |
x-1/2,-y+1/2,-z |
6_455 |
1 |
1 |
98 |
4.7 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.007 |
29 |
|
[MG]A:338 |
1 |
1 |
98 |
◊ |
A |
-y+1/2,x-1/2,z |
3_545 |
1 |
1 |
13382 |
3.8 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.007 |
| Average: |
4.3 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.007 |
| 22 |
30 |
|
[CL]A:344 |
1 |
1 |
125 |
f |
[MG]A:337 |
x,y,z |
1_555 |
1 |
1 |
98 |
2.3 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.009 |
|