## |
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 |
|
C |
105 |
25 |
11388 |
◊ |
A |
x,y,z |
1_555 |
118 |
35 |
11112 |
1088.5 |
-12.7 |
0.090 |
20 |
2 |
0 |
0.596 |
2 |
|
C |
121 |
36 |
11388 |
◊ |
B |
x,y,z |
1_555 |
101 |
25 |
11607 |
1074.2 |
-12.9 |
0.060 |
20 |
2 |
0 |
0.596 |
3 |
|
B |
127 |
36 |
11607 |
◊ |
A |
x,y,z |
1_555 |
103 |
27 |
11112 |
1070.4 |
-12.8 |
0.071 |
20 |
2 |
0 |
0.596 |
Average: |
1077.7 |
-12.8 |
0.074 |
20 |
2 |
0 |
0.596 |
2 |
4 |
|
[UTA]C:303 |
42 |
1 |
933 |
f |
C |
x,y,z |
1_555 |
75 |
24 |
11388 |
541.5 |
3.1 |
0.622 |
8 |
0 |
0 |
0.012 |
3 |
5 |
|
[UTA]B:302 |
43 |
1 |
981 |
f |
B |
x,y,z |
1_555 |
76 |
24 |
11607 |
535.8 |
-0.8 |
0.332 |
8 |
0 |
0 |
0.125 |
6 |
|
[UTA]A:301 |
40 |
1 |
979 |
f |
A |
x,y,z |
1_555 |
79 |
24 |
11112 |
527.4 |
-0.3 |
0.364 |
7 |
0 |
0 |
0.125 |
Average: |
531.6 |
-0.5 |
0.348 |
8 |
0 |
0 |
0.125 |
4 |
7 |
|
B |
41 |
13 |
11607 |
◊ |
B |
y,x,-z |
7_555 |
40 |
12 |
11607 |
409.7 |
0.9 |
0.738 |
2 |
2 |
0 |
0.000 |
5 |
8 |
|
B |
41 |
12 |
11607 |
◊ |
C |
x-1/2,-y-1/2,-z-1/2 |
6_444 |
39 |
10 |
11388 |
343.9 |
-0.5 |
0.581 |
2 |
0 |
0 |
0.000 |
6 |
9 |
|
A |
35 |
11 |
11112 |
◊ |
C |
x-1/2,-y-1/2,-z-1/2 |
6_444 |
35 |
11 |
11388 |
267.5 |
-0.9 |
0.596 |
1 |
0 |
0 |
0.000 |
7 |
10 |
|
[CLM]A:304 |
20 |
1 |
457 |
f |
C |
x,y,z |
1_555 |
34 |
16 |
11388 |
259.1 |
-9.5 |
0.315 |
0 |
0 |
0 |
0.274 |
11 |
|
[CLM]C:301 |
20 |
1 |
453 |
f |
B |
x,y,z |
1_555 |
33 |
15 |
11607 |
238.3 |
-8.4 |
0.313 |
0 |
0 |
0 |
0.274 |
12 |
|
[CLM]B:301 |
20 |
1 |
456 |
f |
A |
x,y,z |
1_555 |
34 |
14 |
11112 |
235.9 |
-8.1 |
0.350 |
1 |
0 |
0 |
0.274 |
Average: |
244.4 |
-8.7 |
0.326 |
0 |
0 |
0 |
0.274 |
8 |
13 |
|
B |
31 |
6 |
11607 |
◊ |
A |
-x,-y-1,z |
2_545 |
29 |
6 |
11112 |
244.0 |
2.0 |
0.828 |
3 |
8 |
0 |
0.009 |
14 |
|
C |
28 |
8 |
11388 |
◊ |
C |
-x,-y-1,z |
2_545 |
28 |
8 |
11388 |
201.2 |
2.3 |
0.866 |
2 |
6 |
0 |
0.009 |
Average: |
222.6 |
2.1 |
0.847 |
3 |
7 |
0 |
0.009 |
9 |
15 |
|
B |
23 |
8 |
11607 |
◊ |
A |
x-1/2,-y-1/2,-z-1/2 |
6_444 |
20 |
6 |
11112 |
207.9 |
1.4 |
0.744 |
3 |
3 |
0 |
0.000 |
10 |
16 |
|
B |
25 |
6 |
11607 |
◊ |
A |
-x-1/2,y-1/2,-z-1/2 |
5_444 |
19 |
5 |
11112 |
199.3 |
-0.9 |
0.540 |
1 |
0 |
0 |
0.000 |
11 |
17 |
|
[PG4]A:303 |
11 |
1 |
407 |
f |
A |
x,y,z |
1_555 |
24 |
7 |
11112 |
138.6 |
2.7 |
0.310 |
0 |
0 |
0 |
0.000 |
12 |
18 |
|
[UTA]A:301 |
14 |
1 |
979 |
◊ |
C |
x-1/2,-y-1/2,-z-1/2 |
6_444 |
16 |
8 |
11388 |
133.7 |
-1.2 |
0.523 |
2 |
0 |
0 |
0.000 |
13 |
19 |
|
[CLM]A:304 |
14 |
1 |
457 |
◊ |
A |
x,y,z |
1_555 |
13 |
7 |
11112 |
124.5 |
-3.9 |
0.274 |
2 |
0 |
0 |
0.107 |
20 |
|
[CLM]C:301 |
14 |
1 |
453 |
◊ |
C |
x,y,z |
1_555 |
15 |
7 |
11388 |
114.0 |
-2.9 |
0.538 |
2 |
0 |
0 |
0.107 |
21 |
|
[CLM]B:301 |
15 |
1 |
456 |
◊ |
B |
x,y,z |
1_555 |
15 |
7 |
11607 |
112.5 |
-2.4 |
0.555 |
2 |
0 |
0 |
0.107 |
Average: |
117.0 |
-3.1 |
0.456 |
2 |
0 |
0 |
0.107 |
14 |
22 |
|
C |
13 |
5 |
11388 |
◊ |
B |
-x,-y-1,z |
2_545 |
16 |
6 |
11607 |
114.9 |
-2.2 |
0.252 |
0 |
0 |
0 |
0.012 |
15 |
23 |
|
B |
15 |
5 |
11607 |
◊ |
A |
-y-1/2,x-1/2,z+1/2 |
3_445 |
12 |
5 |
11112 |
110.1 |
0.5 |
0.688 |
1 |
2 |
0 |
0.000 |
16 |
24 |
|
C |
14 |
3 |
11388 |
◊ |
C |
-x,-y,z |
2_555 |
14 |
3 |
11388 |
107.1 |
0.7 |
0.752 |
0 |
0 |
0 |
0.000 |
17 |
25 |
|
[PEG]C:302 |
6 |
1 |
260 |
◊ |
B |
x,y,z |
1_555 |
19 |
7 |
11607 |
105.3 |
3.4 |
0.472 |
0 |
0 |
0 |
0.000 |
18 |
26 |
|
A |
11 |
6 |
11112 |
◊ |
C |
-y-1/2,x-1/2,z-1/2 |
3_444 |
11 |
5 |
11388 |
96.7 |
-0.1 |
0.557 |
1 |
0 |
0 |
0.000 |
19 |
27 |
|
[PG4]A:303 |
7 |
1 |
407 |
◊ |
B |
x,y,z |
1_555 |
11 |
3 |
11607 |
87.3 |
0.9 |
0.243 |
0 |
0 |
0 |
0.000 |
20 |
28 |
|
[UTA]B:302 |
6 |
1 |
981 |
◊ |
C |
x,y,z |
1_555 |
16 |
5 |
11388 |
82.6 |
-0.9 |
0.493 |
1 |
0 |
0 |
0.021 |
29 |
|
[UTA]A:301 |
6 |
1 |
979 |
◊ |
B |
x,y,z |
1_555 |
16 |
5 |
11607 |
80.8 |
-1.0 |
0.463 |
0 |
0 |
0 |
0.021 |
Average: |
81.7 |
-1.0 |
0.478 |
1 |
0 |
0 |
0.021 |
21 |
30 |
|
A |
11 |
3 |
11112 |
◊ |
A |
-x,-y-1,z |
2_545 |
10 |
3 |
11112 |
74.1 |
-1.3 |
0.354 |
0 |
0 |
0 |
0.004 |
22 |
31 |
|
[UTA]C:303 |
4 |
1 |
933 |
◊ |
A |
x,y,z |
1_555 |
10 |
5 |
11112 |
57.2 |
-1.1 |
0.444 |
1 |
0 |
0 |
0.014 |
23 |
32 |
|
[CLM]B:301 |
5 |
1 |
456 |
f |
[PG4]A:303 |
x,y,z |
1_555 |
5 |
1 |
407 |
48.6 |
-0.4 |
0.368 |
0 |
0 |
0 |
0.006 |
24 |
33 |
|
[PEG]C:302 |
6 |
1 |
260 |
f |
C |
x,y,z |
1_555 |
4 |
2 |
11388 |
48.1 |
-0.0 |
0.065 |
0 |
0 |
0 |
0.000 |
25 |
34 |
|
[ZN]C:304 |
1 |
1 |
98 |
x |
C |
x,y,z |
1_555 |
6 |
2 |
11388 |
46.2 |
-28.4 |
0.000 |
0 |
0 |
0 |
0.727 |
35 |
|
[ZN]A:302 |
1 |
1 |
98 |
x |
B |
-x,-y-1,z |
2_545 |
6 |
2 |
11607 |
35.4 |
-19.5 |
0.000 |
0 |
0 |
0 |
0.727 |
36 |
|
[ZN]A:302 |
1 |
1 |
98 |
x |
A |
x,y,z |
1_555 |
6 |
2 |
11112 |
35.1 |
-19.4 |
0.000 |
0 |
0 |
0 |
0.727 |
Average: |
38.9 |
-22.4 |
0.000 |
0 |
0 |
0 |
0.727 |
26 |
37 |
|
B |
7 |
2 |
11607 |
◊ |
C |
-x-1/2,y-1/2,-z-1/2 |
5_444 |
5 |
2 |
11388 |
46.0 |
-0.2 |
0.491 |
0 |
0 |
0 |
0.000 |
27 |
38 |
|
[CLM]C:301 |
4 |
1 |
453 |
f |
[UTA]B:302 |
x,y,z |
1_555 |
5 |
1 |
981 |
41.5 |
-0.1 |
0.588 |
0 |
0 |
0 |
0.023 |
39 |
|
[CLM]B:301 |
4 |
1 |
456 |
f |
[UTA]A:301 |
x,y,z |
1_555 |
5 |
1 |
979 |
40.9 |
-0.1 |
0.590 |
0 |
0 |
0 |
0.023 |
40 |
|
[CLM]A:304 |
2 |
1 |
457 |
f |
[UTA]C:303 |
x,y,z |
1_555 |
4 |
1 |
933 |
29.6 |
-0.5 |
0.474 |
1 |
0 |
0 |
0.023 |
Average: |
37.3 |
-0.2 |
0.551 |
0 |
0 |
0 |
0.023 |
28 |
41 |
|
[PEG]C:302 |
4 |
1 |
260 |
◊ |
[CLM]C:301 |
x,y,z |
1_555 |
4 |
1 |
453 |
38.0 |
0.2 |
0.304 |
0 |
0 |
0 |
0.000 |
29 |
42 |
|
B |
2 |
1 |
11607 |
x |
B |
-x-1/2,y-1/2,-z-1/2 |
5_444 |
4 |
3 |
11607 |
25.6 |
-0.8 |
0.221 |
0 |
0 |
0 |
0.000 |
|