| ## |
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 |
125 |
36 |
14412 |
◊ |
A |
x,y,z |
1_555 |
132 |
36 |
14386 |
1305.2 |
-20.9 |
0.019 |
19 |
1 |
0 |
0.129 |
| 2 |
2 |
|
B |
111 |
34 |
14412 |
x |
B |
x-y,x,z+1/6 |
6_555 |
79 |
25 |
14412 |
794.9 |
0.3 |
0.762 |
10 |
2 |
0 |
0.000 |
3 |
|
A |
80 |
23 |
14386 |
x |
A |
x-y,x,z+1/6 |
6_555 |
108 |
31 |
14386 |
762.9 |
-0.9 |
0.715 |
10 |
2 |
0 |
0.000 |
| Average: |
778.9 |
-0.3 |
0.739 |
10 |
2 |
0 |
0.000 |
| 3 |
4 |
|
[ADP]A:411 |
27 |
1 |
543 |
f |
A |
x,y,z |
1_555 |
48 |
19 |
14386 |
372.5 |
-4.9 |
0.450 |
4 |
0 |
0 |
0.059 |
5 |
|
[ADP]B:511 |
27 |
1 |
542 |
f |
B |
x,y,z |
1_555 |
48 |
20 |
14412 |
371.3 |
-4.6 |
0.475 |
5 |
0 |
0 |
0.059 |
| Average: |
371.9 |
-4.7 |
0.462 |
5 |
0 |
0 |
0.059 |
| 4 |
6 |
|
B |
46 |
14 |
14412 |
◊ |
A |
x-y,x,z+1/6 |
6_555 |
41 |
12 |
14386 |
351.9 |
-3.1 |
0.421 |
1 |
0 |
0 |
0.000 |
| 5 |
7 |
|
A |
36 |
14 |
14386 |
◊ |
B |
x-y-1,x,z+1/6 |
6_455 |
33 |
14 |
14412 |
340.1 |
-0.2 |
0.512 |
2 |
3 |
0 |
0.000 |
| 6 |
8 |
|
[GOL]A:401 |
6 |
1 |
221 |
f |
A |
x,y,z |
1_555 |
22 |
13 |
14386 |
129.3 |
-0.3 |
0.562 |
3 |
0 |
0 |
0.007 |
| 7 |
9 |
|
[CL]B:506 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
17 |
9 |
14412 |
85.9 |
-12.2 |
0.000 |
0 |
0 |
0 |
0.107 |
10 |
|
[CL]A:410 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
16 |
9 |
14386 |
84.3 |
-12.2 |
0.000 |
0 |
0 |
0 |
0.107 |
| Average: |
85.1 |
-12.2 |
0.000 |
0 |
0 |
0 |
0.107 |
| 8 |
11 |
|
[GOL]B:501 |
6 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
14412 |
71.9 |
-0.2 |
0.523 |
3 |
0 |
0 |
0.007 |
| 9 |
12 |
|
[CL]A:409 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
14386 |
69.4 |
-11.4 |
0.000 |
0 |
0 |
0 |
0.099 |
13 |
|
[CL]B:507 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
14412 |
69.1 |
-11.2 |
0.000 |
0 |
0 |
0 |
0.099 |
| Average: |
69.2 |
-11.3 |
0.000 |
0 |
0 |
0 |
0.099 |
| 10 |
14 |
|
[NA]B:503 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
11 |
7 |
14412 |
67.0 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.109 |
15 |
|
[NA]A:403 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
11 |
7 |
14386 |
65.4 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.109 |
| Average: |
66.2 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.109 |
| 11 |
16 |
|
[NA]A:407 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
14386 |
66.3 |
-9.1 |
0.000 |
0 |
0 |
0 |
0.040 |
| 12 |
17 |
|
[GOL]B:501 |
6 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
10 |
5 |
14386 |
65.0 |
-0.2 |
0.570 |
1 |
0 |
0 |
0.003 |
| 13 |
18 |
|
[CL]B:510 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
14412 |
62.4 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.055 |
| 14 |
19 |
|
[CL]B:505 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
14412 |
61.1 |
-8.2 |
0.000 |
0 |
0 |
0 |
0.036 |
| 15 |
20 |
|
[CL]A:408 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
14386 |
58.0 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.073 |
21 |
|
[CL]B:508 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
13 |
4 |
14412 |
56.8 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.073 |
| Average: |
57.4 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.073 |
| 16 |
22 |
|
[NA]A:405 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
14386 |
58.0 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.033 |
| 17 |
23 |
|
[CL]B:509 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
12 |
3 |
14412 |
57.7 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.033 |
| 18 |
24 |
|
[NA]B:504 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
9 |
3 |
14412 |
56.0 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.031 |
| 19 |
25 |
|
[NA]B:502 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
14412 |
54.0 |
-8.0 |
0.000 |
0 |
0 |
0 |
0.065 |
26 |
|
[NA]A:402 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
14386 |
47.6 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.065 |
| Average: |
50.8 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.065 |
| 20 |
27 |
|
A |
10 |
6 |
14386 |
f |
[NA]A:406 |
x-y,x,z+1/6 |
6_555 |
1 |
1 |
125 |
53.9 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.034 |
| 21 |
28 |
|
[NA]A:404 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
7 |
2 |
14386 |
53.0 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.030 |
| 22 |
29 |
|
A |
5 |
3 |
14386 |
◊ |
B |
-y-1,x-y,z+1/3 |
2_455 |
7 |
4 |
14412 |
50.0 |
-0.3 |
0.459 |
0 |
0 |
0 |
0.000 |
| 23 |
30 |
|
B |
7 |
3 |
14412 |
◊ |
[GOL]B:501 |
x-y,x,z+1/6 |
6_555 |
4 |
1 |
216 |
43.1 |
0.1 |
0.579 |
0 |
0 |
0 |
0.000 |
| 24 |
31 |
|
A |
7 |
3 |
14386 |
◊ |
[CL]B:509 |
x-y-1,x,z+1/6 |
6_455 |
1 |
1 |
125 |
40.9 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.000 |
| 25 |
32 |
|
[NA]B:502 |
1 |
1 |
125 |
◊ |
B |
x-y,x,z+1/6 |
6_555 |
9 |
4 |
14412 |
40.7 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.000 |
33 |
|
A |
9 |
4 |
14386 |
◊ |
[NA]A:402 |
x-y,x,z+1/6 |
6_555 |
1 |
1 |
125 |
39.8 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.000 |
| Average: |
40.3 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.000 |
| 26 |
34 |
|
[NA]A:406 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
7 |
4 |
14386 |
34.5 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.000 |
| 27 |
35 |
|
[CL]A:408 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
14412 |
32.0 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.031 |
36 |
|
[CL]B:508 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
4 |
1 |
14386 |
27.6 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.031 |
| Average: |
29.8 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.031 |
| 28 |
37 |
|
A |
4 |
3 |
14386 |
◊ |
B |
x-y,x,z+1/6 |
6_555 |
4 |
2 |
14412 |
30.9 |
0.7 |
0.812 |
0 |
0 |
0 |
0.000 |
| 29 |
38 |
|
[NA]B:504 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
14386 |
26.7 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.013 |
| 30 |
39 |
|
[NA]B:504 |
1 |
1 |
125 |
◊ |
B |
x-y,x,z+1/6 |
6_555 |
3 |
1 |
14412 |
24.5 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.000 |
| 31 |
40 |
|
[CL]B:505 |
1 |
1 |
125 |
◊ |
B |
x-y,x,z+1/6 |
6_555 |
3 |
2 |
14412 |
20.6 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.000 |
| 32 |
41 |
|
A |
2 |
2 |
14386 |
x |
A |
-y-1,x-y,z+1/3 |
2_455 |
4 |
2 |
14386 |
15.0 |
0.1 |
0.666 |
0 |
0 |
0 |
0.000 |
| 33 |
42 |
|
[NA]A:406 |
1 |
1 |
125 |
◊ |
[NA]A:402 |
x,y,z |
1_555 |
1 |
1 |
125 |
13.6 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.000 |
| 34 |
43 |
|
[NA]A:404 |
1 |
1 |
125 |
◊ |
B |
x-y-1,x,z+1/6 |
6_455 |
2 |
1 |
14412 |
11.1 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.000 |
| 35 |
44 |
|
[CL]B:508 |
1 |
1 |
125 |
f |
[GOL]B:501 |
x,y,z |
1_555 |
1 |
1 |
216 |
10.8 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.005 |
| 36 |
45 |
|
[NA]A:405 |
1 |
1 |
125 |
◊ |
B |
-y-1,x-y,z+1/3 |
2_455 |
1 |
1 |
14412 |
1.1 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
|