| ## |
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 |
158 |
46 |
24454 |
◊ |
A |
x,y,z |
1_555 |
158 |
44 |
24210 |
1413.1 |
-6.0 |
0.348 |
10 |
1 |
0 |
0.036 |
| 2 |
2 |
|
B |
45 |
9 |
24454 |
◊ |
A |
-x-1,y-1/2,-z |
2_445 |
55 |
15 |
24210 |
471.6 |
-4.2 |
0.176 |
2 |
1 |
0 |
0.000 |
| 3 |
3 |
|
A |
51 |
14 |
24210 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
51 |
15 |
24454 |
462.4 |
-0.3 |
0.517 |
1 |
0 |
0 |
0.000 |
| 4 |
4 |
|
A |
48 |
14 |
24210 |
x |
A |
-x-1,y-1/2,-z |
2_445 |
52 |
13 |
24210 |
402.4 |
-3.6 |
0.178 |
2 |
0 |
0 |
0.000 |
| 5 |
5 |
|
A |
44 |
13 |
24210 |
◊ |
B |
x,y,z-1 |
1_554 |
43 |
13 |
24454 |
345.8 |
-2.1 |
0.382 |
2 |
0 |
0 |
0.000 |
| 6 |
6 |
|
B |
33 |
11 |
24454 |
x |
B |
x,y-1,z |
1_545 |
25 |
8 |
24454 |
287.2 |
2.3 |
0.792 |
1 |
0 |
0 |
0.000 |
| 7 |
7 |
|
A |
21 |
7 |
24210 |
x |
A |
-x,y-1/2,-z |
2_545 |
28 |
12 |
24210 |
198.6 |
3.0 |
0.853 |
1 |
0 |
0 |
0.000 |
| 8 |
8 |
|
A |
30 |
10 |
24210 |
◊ |
B |
-x-1,y-1/2,-z |
2_445 |
20 |
9 |
24454 |
198.2 |
1.5 |
0.743 |
0 |
1 |
0 |
0.000 |
| 9 |
9 |
|
[SF4]B:601 |
8 |
1 |
308 |
f |
B |
x,y,z |
1_555 |
24 |
14 |
24454 |
190.3 |
-21.8 |
0.180 |
0 |
0 |
0 |
0.146 |
10 |
|
[SF4]A:601 |
8 |
1 |
307 |
f |
A |
x,y,z |
1_555 |
27 |
15 |
24210 |
188.7 |
-21.7 |
0.228 |
0 |
0 |
0 |
0.146 |
| Average: |
189.5 |
-21.7 |
0.204 |
0 |
0 |
0 |
0.146 |
| 10 |
11 |
|
[SF4]B:604 |
8 |
1 |
310 |
f |
B |
x,y,z |
1_555 |
28 |
14 |
24454 |
187.7 |
-21.8 |
0.259 |
0 |
0 |
0 |
0.146 |
12 |
|
[SF4]A:604 |
8 |
1 |
308 |
f |
A |
x,y,z |
1_555 |
28 |
13 |
24210 |
186.0 |
-21.7 |
0.267 |
0 |
0 |
0 |
0.146 |
| Average: |
186.8 |
-21.7 |
0.263 |
0 |
0 |
0 |
0.146 |
| 11 |
13 |
|
[SF4]A:602 |
8 |
1 |
309 |
f |
A |
x,y,z |
1_555 |
24 |
14 |
24210 |
183.7 |
-21.4 |
0.284 |
0 |
0 |
0 |
0.144 |
14 |
|
[SF4]B:602 |
8 |
1 |
309 |
f |
B |
x,y,z |
1_555 |
24 |
14 |
24454 |
182.8 |
-21.4 |
0.297 |
0 |
0 |
0 |
0.144 |
| Average: |
183.3 |
-21.4 |
0.291 |
0 |
0 |
0 |
0.144 |
| 12 |
15 |
|
[SF4]A:603 |
8 |
1 |
309 |
f |
A |
x,y,z |
1_555 |
22 |
12 |
24210 |
180.3 |
-21.3 |
0.321 |
0 |
0 |
0 |
0.143 |
16 |
|
[SF4]B:603 |
8 |
1 |
308 |
f |
B |
x,y,z |
1_555 |
23 |
12 |
24454 |
180.0 |
-21.2 |
0.309 |
0 |
0 |
0 |
0.143 |
| Average: |
180.2 |
-21.2 |
0.315 |
0 |
0 |
0 |
0.143 |
| 13 |
17 |
|
[GOL]B:610 |
6 |
1 |
221 |
f |
B |
x,y,z |
1_555 |
18 |
10 |
24454 |
129.0 |
0.7 |
0.686 |
4 |
0 |
0 |
0.006 |
18 |
|
[GOL]A:609 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
18 |
10 |
24210 |
128.1 |
0.7 |
0.687 |
3 |
0 |
0 |
0.006 |
| Average: |
128.5 |
0.7 |
0.686 |
4 |
0 |
0 |
0.006 |
| 14 |
19 |
|
[FES]A:606 |
4 |
1 |
236 |
f |
A |
x,y,z |
1_555 |
13 |
11 |
24210 |
124.8 |
-16.6 |
0.556 |
0 |
0 |
0 |
0.112 |
20 |
|
[FES]B:605 |
4 |
1 |
236 |
f |
B |
x,y,z |
1_555 |
14 |
11 |
24454 |
124.7 |
-16.6 |
0.565 |
0 |
0 |
0 |
0.112 |
| Average: |
124.8 |
-16.6 |
0.561 |
0 |
0 |
0 |
0.112 |
| 15 |
21 |
|
[GOL]B:611 |
6 |
1 |
218 |
f |
B |
x,y,z |
1_555 |
19 |
5 |
24454 |
114.9 |
-0.4 |
0.555 |
0 |
0 |
0 |
0.001 |
| 16 |
22 |
|
[CL]A:608 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
14 |
8 |
24210 |
69.7 |
-12.3 |
0.000 |
0 |
0 |
0 |
0.083 |
23 |
|
[CL]B:606 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
13 |
8 |
24454 |
69.1 |
-12.3 |
0.000 |
0 |
0 |
0 |
0.083 |
| Average: |
69.4 |
-12.3 |
0.000 |
0 |
0 |
0 |
0.083 |
| 17 |
24 |
|
[CL]B:607 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
9 |
6 |
24454 |
67.1 |
-10.3 |
0.000 |
0 |
0 |
0 |
0.069 |
25 |
|
[CL]A:610 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
24210 |
67.0 |
-10.3 |
0.000 |
0 |
0 |
0 |
0.069 |
| Average: |
67.0 |
-10.3 |
0.000 |
0 |
0 |
0 |
0.069 |
| 18 |
26 |
|
A |
10 |
3 |
24210 |
◊ |
B |
x,y-1,z |
1_545 |
10 |
6 |
24454 |
65.8 |
0.6 |
0.676 |
1 |
2 |
0 |
0.000 |
| 19 |
27 |
|
[MG]B:608 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
11 |
7 |
24454 |
57.1 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.047 |
28 |
|
[MG]A:605 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
12 |
7 |
24210 |
57.0 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.047 |
| Average: |
57.0 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.047 |
| 20 |
29 |
|
[MG]B:609 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
24454 |
50.9 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.047 |
30 |
|
[MG]A:607 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
24210 |
50.2 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.047 |
| Average: |
50.6 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.047 |
| 21 |
31 |
|
[MG]B:609 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
24210 |
22.9 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.017 |
32 |
|
[MG]A:607 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
24454 |
21.8 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.017 |
| Average: |
22.4 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.017 |
| 22 |
33 |
|
[CL]B:606 |
1 |
1 |
125 |
f |
[SF4]B:601 |
x,y,z |
1_555 |
1 |
1 |
308 |
3.4 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.004 |
34 |
|
[CL]A:608 |
1 |
1 |
125 |
f |
[SF4]A:601 |
x,y,z |
1_555 |
1 |
1 |
307 |
3.2 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.004 |
| Average: |
3.3 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.004 |
| 23 |
35 |
|
A |
2 |
1 |
24210 |
x |
A |
x,y-1,z |
1_545 |
1 |
1 |
24210 |
2.2 |
-0.0 |
0.625 |
0 |
0 |
0 |
0.000 |
|