## |
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 |
|
F |
92 |
23 |
13449 |
◊ |
B |
x,y,z |
1_555 |
91 |
25 |
13351 |
835.9 |
-13.4 |
0.078 |
14 |
6 |
0 |
0.678 |
2 |
|
E |
92 |
24 |
13526 |
◊ |
C |
x,y,z |
1_555 |
91 |
23 |
13123 |
835.7 |
-13.7 |
0.065 |
12 |
6 |
0 |
0.678 |
3 |
|
D |
93 |
24 |
13461 |
◊ |
A |
x,y,z |
1_555 |
94 |
24 |
13659 |
834.0 |
-12.6 |
0.110 |
11 |
6 |
0 |
0.678 |
Average: |
835.2 |
-13.2 |
0.084 |
12 |
6 |
0 |
0.678 |
2 |
4 |
|
F |
76 |
21 |
13449 |
◊ |
C |
x,y,z |
1_555 |
71 |
21 |
13123 |
757.8 |
-6.7 |
0.326 |
16 |
0 |
0 |
0.650 |
5 |
|
D |
78 |
23 |
13461 |
◊ |
B |
x,y,z |
1_555 |
72 |
22 |
13351 |
756.8 |
-7.1 |
0.315 |
16 |
0 |
0 |
0.650 |
6 |
|
E |
75 |
23 |
13526 |
◊ |
A |
x,y,z |
1_555 |
75 |
22 |
13659 |
751.8 |
-7.2 |
0.317 |
15 |
0 |
0 |
0.650 |
Average: |
755.5 |
-7.0 |
0.319 |
16 |
0 |
0 |
0.650 |
3 |
7 |
|
C |
76 |
23 |
13123 |
◊ |
A |
x,y,z |
1_555 |
64 |
19 |
13659 |
623.6 |
-2.0 |
0.557 |
6 |
6 |
0 |
0.153 |
8 |
|
E |
64 |
16 |
13526 |
◊ |
D |
x,y,z |
1_555 |
72 |
22 |
13461 |
583.3 |
0.2 |
0.732 |
8 |
6 |
0 |
0.153 |
9 |
|
B |
55 |
15 |
13351 |
◊ |
A |
x,y,z |
1_555 |
65 |
20 |
13659 |
563.1 |
-1.2 |
0.483 |
6 |
6 |
0 |
0.153 |
10 |
|
F |
65 |
20 |
13449 |
◊ |
D |
x,y,z |
1_555 |
56 |
15 |
13461 |
541.8 |
-0.4 |
0.715 |
7 |
7 |
0 |
0.153 |
11 |
|
F |
53 |
14 |
13449 |
◊ |
E |
x,y,z |
1_555 |
67 |
21 |
13526 |
539.4 |
-0.0 |
0.638 |
6 |
6 |
0 |
0.153 |
12 |
|
C |
37 |
11 |
13123 |
◊ |
B |
x,y,z |
1_555 |
43 |
12 |
13351 |
378.7 |
0.1 |
0.730 |
6 |
6 |
0 |
0.153 |
Average: |
538.3 |
-0.6 |
0.643 |
7 |
6 |
0 |
0.153 |
4 |
13 |
|
C |
60 |
16 |
13123 |
◊ |
F |
-x+1,y-1/2,-z+3/2 |
3_646 |
62 |
15 |
13449 |
511.7 |
5.0 |
0.963 |
10 |
8 |
0 |
0.000 |
5 |
14 |
|
D |
33 |
12 |
13461 |
◊ |
F |
-x+1/2,-y+1,z-1/2 |
2_564 |
37 |
11 |
13449 |
334.1 |
-3.3 |
0.361 |
1 |
0 |
0 |
0.000 |
6 |
15 |
|
C |
19 |
5 |
13123 |
◊ |
E |
x-1/2,-y+1/2,-z+1 |
4_456 |
20 |
6 |
13526 |
184.2 |
-2.4 |
0.321 |
0 |
0 |
0 |
0.000 |
7 |
16 |
|
[MES]D:402 |
8 |
1 |
274 |
f |
D |
x,y,z |
1_555 |
20 |
9 |
13461 |
150.4 |
4.3 |
0.495 |
0 |
0 |
0 |
0.000 |
8 |
17 |
|
A |
19 |
7 |
13659 |
◊ |
C |
-x+3/2,-y+1,z-1/2 |
2_664 |
23 |
8 |
13123 |
146.4 |
-2.4 |
0.351 |
0 |
0 |
0 |
0.000 |
9 |
18 |
|
[MES]D:404 |
9 |
1 |
336 |
◊ |
D |
x,y,z |
1_555 |
26 |
10 |
13461 |
146.2 |
3.2 |
0.231 |
0 |
0 |
0 |
0.000 |
10 |
19 |
|
[MES]A:402 |
8 |
1 |
269 |
◊ |
A |
x,y,z |
1_555 |
20 |
9 |
13659 |
140.5 |
3.9 |
0.454 |
0 |
0 |
0 |
0.000 |
11 |
20 |
|
[MES]D:404 |
9 |
1 |
336 |
f |
A |
x,y,z |
1_555 |
24 |
11 |
13659 |
133.9 |
2.9 |
0.200 |
0 |
0 |
0 |
0.000 |
12 |
21 |
|
[MES]D:403 |
10 |
1 |
336 |
f |
D |
x,y,z |
1_555 |
21 |
5 |
13461 |
132.7 |
3.3 |
0.148 |
0 |
0 |
0 |
0.000 |
13 |
22 |
|
[MES]C:403 |
7 |
1 |
243 |
◊ |
C |
x,y,z |
1_555 |
17 |
9 |
13123 |
130.6 |
1.7 |
0.296 |
0 |
0 |
0 |
0.000 |
14 |
23 |
|
[MES]F:402 |
7 |
1 |
244 |
f |
F |
x,y,z |
1_555 |
19 |
8 |
13449 |
128.5 |
1.7 |
0.329 |
0 |
0 |
0 |
0.000 |
15 |
24 |
|
[MES]F:403 |
8 |
1 |
273 |
◊ |
F |
x,y,z |
1_555 |
21 |
7 |
13449 |
125.4 |
4.0 |
0.473 |
0 |
0 |
0 |
0.000 |
16 |
25 |
|
A |
12 |
2 |
13659 |
◊ |
E |
x-1/2,-y+1/2,-z+1 |
4_456 |
17 |
6 |
13526 |
120.7 |
-1.2 |
0.346 |
0 |
0 |
0 |
0.000 |
17 |
26 |
|
[MES]E:402 |
7 |
1 |
245 |
f |
E |
x,y,z |
1_555 |
20 |
8 |
13526 |
120.1 |
2.4 |
0.369 |
0 |
0 |
0 |
0.000 |
18 |
27 |
|
[MES]B:402 |
7 |
1 |
242 |
f |
B |
x,y,z |
1_555 |
21 |
4 |
13351 |
107.9 |
2.1 |
0.357 |
0 |
0 |
0 |
0.000 |
19 |
28 |
|
[MES]C:404 |
6 |
1 |
227 |
◊ |
E |
x,y,z |
1_555 |
18 |
8 |
13526 |
104.4 |
2.4 |
0.398 |
0 |
0 |
0 |
0.000 |
20 |
29 |
|
[MES]B:403 |
5 |
1 |
202 |
f |
B |
x,y,z |
1_555 |
16 |
7 |
13351 |
103.6 |
2.3 |
0.473 |
0 |
0 |
0 |
0.000 |
21 |
30 |
|
[MES]C:402 |
6 |
1 |
225 |
f |
C |
x,y,z |
1_555 |
20 |
4 |
13123 |
101.6 |
2.7 |
0.320 |
0 |
0 |
0 |
0.000 |
22 |
31 |
|
[MES]F:403 |
8 |
1 |
273 |
f |
B |
x,y,z |
1_555 |
20 |
7 |
13351 |
101.4 |
1.6 |
0.160 |
0 |
0 |
0 |
0.000 |
23 |
32 |
|
[MES]E:403 |
5 |
1 |
225 |
◊ |
E |
x,y,z |
1_555 |
20 |
4 |
13526 |
100.9 |
1.7 |
0.385 |
0 |
0 |
0 |
0.000 |
24 |
33 |
|
[MES]C:404 |
6 |
1 |
227 |
f |
C |
x,y,z |
1_555 |
18 |
7 |
13123 |
97.0 |
1.4 |
0.226 |
0 |
0 |
0 |
0.000 |
25 |
34 |
|
[SO4]A:403 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
19 |
4 |
13659 |
88.3 |
-13.8 |
0.833 |
2 |
0 |
0 |
0.360 |
26 |
35 |
|
B |
12 |
4 |
13351 |
◊ |
E |
x-1,y,z |
1_455 |
8 |
3 |
13526 |
86.5 |
0.0 |
0.676 |
3 |
4 |
0 |
0.000 |
27 |
36 |
|
B |
12 |
5 |
13351 |
◊ |
F |
-x+1/2,-y+1,z-1/2 |
2_564 |
8 |
3 |
13449 |
72.6 |
-0.4 |
0.329 |
0 |
0 |
0 |
0.000 |
28 |
37 |
|
[FMT]B:404 |
3 |
1 |
148 |
f |
B |
x,y,z |
1_555 |
14 |
6 |
13351 |
69.2 |
-0.1 |
0.402 |
1 |
0 |
0 |
0.023 |
29 |
38 |
|
[NA]A:401 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
13659 |
65.3 |
-10.8 |
0.000 |
0 |
0 |
0 |
0.982 |
39 |
|
[NA]F:401 |
1 |
1 |
125 |
f |
F |
x,y,z |
1_555 |
10 |
6 |
13449 |
64.6 |
-10.8 |
0.000 |
0 |
0 |
0 |
0.982 |
40 |
|
[NA]B:401 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
10 |
6 |
13351 |
64.5 |
-10.8 |
0.000 |
0 |
0 |
0 |
0.982 |
41 |
|
[NA]D:401 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
10 |
6 |
13461 |
64.4 |
-10.7 |
0.000 |
0 |
0 |
0 |
0.982 |
42 |
|
[NA]E:401 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
10 |
6 |
13526 |
64.4 |
-10.2 |
0.000 |
0 |
0 |
0 |
0.982 |
43 |
|
[NA]C:401 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
10 |
6 |
13123 |
64.3 |
-10.9 |
0.000 |
0 |
0 |
0 |
0.982 |
Average: |
64.6 |
-10.7 |
0.000 |
0 |
0 |
0 |
0.982 |
30 |
44 |
|
A |
4 |
2 |
13659 |
◊ |
D |
-x+1,y-1/2,-z+1/2 |
3_645 |
7 |
2 |
13461 |
42.4 |
-0.2 |
0.549 |
0 |
0 |
0 |
0.000 |
31 |
45 |
|
B |
2 |
1 |
13351 |
f |
[MES]E:403 |
x-1/2,-y+1/2,-z+1 |
4_456 |
5 |
1 |
225 |
30.3 |
0.7 |
0.043 |
0 |
0 |
0 |
0.000 |
32 |
46 |
|
B |
3 |
1 |
13351 |
◊ |
E |
x-1/2,-y+1/2,-z+1 |
4_456 |
3 |
2 |
13526 |
21.9 |
-0.0 |
0.573 |
0 |
0 |
0 |
0.000 |
33 |
47 |
|
B |
1 |
1 |
13351 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
4 |
1 |
13659 |
21.9 |
-0.2 |
0.257 |
0 |
0 |
0 |
0.000 |
34 |
48 |
|
B |
1 |
1 |
13351 |
◊ |
C |
x-1/2,-y+1/2,-z+1 |
4_456 |
2 |
1 |
13123 |
14.3 |
-0.5 |
0.198 |
0 |
0 |
0 |
0.000 |
35 |
49 |
|
[NA]C:401 |
1 |
1 |
125 |
◊ |
F |
-x+1,y-1/2,-z+3/2 |
3_646 |
2 |
1 |
13449 |
12.5 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.000 |
50 |
|
C |
2 |
1 |
13123 |
◊ |
[NA]F:401 |
-x+1,y-1/2,-z+3/2 |
3_646 |
1 |
1 |
125 |
11.4 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
11.9 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.000 |
36 |
51 |
|
B |
1 |
1 |
13351 |
◊ |
C |
-x+1/2,-y+1,z-1/2 |
2_564 |
1 |
1 |
13123 |
10.0 |
0.0 |
0.437 |
0 |
0 |
0 |
0.000 |
37 |
52 |
|
A |
2 |
1 |
13659 |
f |
[MES]C:403 |
-x+3/2,-y+1,z-1/2 |
2_664 |
1 |
1 |
243 |
8.6 |
-0.0 |
0.330 |
0 |
0 |
0 |
0.001 |
38 |
53 |
|
C |
2 |
2 |
13123 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
3 |
1 |
13659 |
8.3 |
0.2 |
0.732 |
0 |
0 |
0 |
0.000 |
39 |
54 |
|
[MES]A:402 |
1 |
1 |
269 |
f |
C |
-x+3/2,-y+1,z-1/2 |
2_664 |
1 |
1 |
13123 |
5.1 |
-0.0 |
0.283 |
0 |
0 |
0 |
0.000 |
40 |
55 |
|
E |
1 |
1 |
13526 |
◊ |
F |
-x+3/2,-y+1,z-1/2 |
2_664 |
1 |
1 |
13449 |
3.7 |
0.0 |
0.545 |
0 |
0 |
0 |
0.000 |
41 |
56 |
|
A |
1 |
1 |
13659 |
◊ |
F |
-x+3/2,-y+1,z-1/2 |
2_664 |
1 |
1 |
13449 |
1.8 |
-0.1 |
0.445 |
0 |
0 |
0 |
0.000 |
42 |
57 |
|
[NA]B:401 |
1 |
1 |
125 |
◊ |
E |
x-1,y,z |
1_455 |
1 |
1 |
13526 |
0.9 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
|