## |
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 |
|
L |
190 |
58 |
11246 |
◊ |
H |
x,y,z |
1_555 |
194 |
56 |
11021 |
1766.3 |
-22.5 |
0.116 |
15 |
3 |
0 |
0.435 |
2 |
|
Y |
187 |
58 |
11242 |
◊ |
X |
x,y,z |
1_555 |
193 |
56 |
11017 |
1766.1 |
-22.6 |
0.110 |
12 |
3 |
0 |
0.435 |
3 |
|
M |
191 |
58 |
11233 |
◊ |
K |
x,y,z |
1_555 |
190 |
56 |
11028 |
1758.6 |
-22.9 |
0.103 |
14 |
2 |
0 |
0.435 |
Average: |
1763.7 |
-22.7 |
0.110 |
14 |
3 |
0 |
0.435 |
2 |
4 |
|
C |
106 |
28 |
7605 |
◊ |
B |
x,y,z |
1_555 |
103 |
31 |
7618 |
940.5 |
-9.0 |
0.267 |
13 |
0 |
0 |
1.000 |
5 |
|
B |
108 |
28 |
7618 |
◊ |
A |
x,y,z |
1_555 |
104 |
30 |
7594 |
938.4 |
-9.1 |
0.264 |
13 |
0 |
0 |
1.000 |
6 |
|
C |
101 |
30 |
7605 |
◊ |
A |
x,y,z |
1_555 |
105 |
28 |
7594 |
937.3 |
-8.9 |
0.262 |
13 |
0 |
0 |
1.000 |
Average: |
938.7 |
-9.0 |
0.265 |
13 |
0 |
0 |
1.000 |
3 |
7 |
|
K |
51 |
16 |
11028 |
◊ |
B |
x,y,z |
1_555 |
58 |
20 |
7618 |
482.4 |
0.1 |
0.518 |
5 |
0 |
0 |
0.000 |
8 |
|
H |
54 |
15 |
11021 |
◊ |
A |
x,y,z |
1_555 |
57 |
20 |
7594 |
473.9 |
0.1 |
0.535 |
7 |
0 |
0 |
0.000 |
9 |
|
X |
51 |
15 |
11017 |
◊ |
C |
x,y,z |
1_555 |
58 |
20 |
7605 |
471.8 |
-0.0 |
0.526 |
6 |
0 |
0 |
0.000 |
Average: |
476.0 |
0.1 |
0.526 |
6 |
0 |
0 |
0.000 |
4 |
10 |
|
Y |
36 |
15 |
11242 |
◊ |
L |
-x+1/2,y-1/2,-z |
4_545 |
38 |
15 |
11246 |
367.9 |
3.7 |
0.930 |
12 |
5 |
0 |
0.000 |
11 |
|
M |
39 |
16 |
11233 |
◊ |
M |
-x+1,y,-z |
2_655 |
39 |
16 |
11233 |
356.3 |
3.6 |
0.926 |
10 |
4 |
0 |
0.000 |
Average: |
362.1 |
3.7 |
0.928 |
11 |
5 |
0 |
0.000 |
5 |
12 |
|
Y |
35 |
12 |
11242 |
◊ |
B |
-x+1/2,y-1/2,-z |
4_545 |
34 |
10 |
7618 |
330.0 |
-0.0 |
0.638 |
4 |
0 |
0 |
0.000 |
13 |
|
M |
35 |
12 |
11233 |
◊ |
C |
-x+1,y,-z |
2_655 |
32 |
10 |
7605 |
325.1 |
-0.2 |
0.619 |
4 |
0 |
0 |
0.000 |
14 |
|
A |
34 |
10 |
7594 |
◊ |
L |
-x+1/2,y-1/2,-z |
4_545 |
35 |
12 |
11246 |
323.1 |
0.1 |
0.654 |
4 |
0 |
0 |
0.000 |
Average: |
326.1 |
-0.0 |
0.637 |
4 |
0 |
0 |
0.000 |
6 |
15 |
|
X |
40 |
15 |
11017 |
◊ |
K |
-x+1,y,-z+1 |
2_656 |
41 |
17 |
11028 |
318.9 |
0.2 |
0.816 |
2 |
0 |
0 |
0.000 |
7 |
16 |
|
Y |
40 |
9 |
11242 |
◊ |
C |
x,y,z |
1_555 |
32 |
13 |
7605 |
296.4 |
-1.5 |
0.557 |
6 |
0 |
0 |
0.000 |
17 |
|
L |
38 |
9 |
11246 |
◊ |
A |
x,y,z |
1_555 |
32 |
13 |
7594 |
293.0 |
-1.6 |
0.536 |
5 |
0 |
0 |
0.000 |
18 |
|
M |
39 |
9 |
11233 |
◊ |
B |
x,y,z |
1_555 |
33 |
13 |
7618 |
292.8 |
-1.6 |
0.542 |
5 |
0 |
0 |
0.000 |
Average: |
294.1 |
-1.6 |
0.545 |
5 |
0 |
0 |
0.000 |
8 |
19 |
|
Y |
28 |
12 |
11242 |
◊ |
A |
-x+1/2,y-1/2,-z |
4_545 |
23 |
8 |
7594 |
228.5 |
-0.6 |
0.568 |
2 |
0 |
0 |
0.000 |
20 |
|
C |
23 |
8 |
7605 |
◊ |
L |
-x+1/2,y-1/2,-z |
4_545 |
27 |
12 |
11246 |
222.7 |
-0.6 |
0.564 |
2 |
0 |
0 |
0.000 |
21 |
|
M |
27 |
12 |
11233 |
◊ |
B |
-x+1,y,-z |
2_655 |
23 |
8 |
7618 |
218.9 |
-0.6 |
0.567 |
2 |
0 |
0 |
0.000 |
Average: |
223.4 |
-0.6 |
0.567 |
2 |
0 |
0 |
0.000 |
9 |
22 |
|
X |
30 |
12 |
11017 |
◊ |
H |
-x+1/2,y-1/2,-z+1 |
4_546 |
24 |
10 |
11021 |
222.9 |
0.3 |
0.791 |
2 |
0 |
0 |
0.000 |
10 |
23 |
|
X |
24 |
8 |
11017 |
◊ |
M |
x-1/2,y-1/2,z |
3_445 |
25 |
10 |
11233 |
218.1 |
-3.4 |
0.274 |
1 |
0 |
0 |
0.000 |
24 |
|
L |
24 |
9 |
11246 |
◊ |
K |
x-1/2,y+1/2,z |
3_455 |
21 |
8 |
11028 |
208.0 |
-3.3 |
0.258 |
1 |
0 |
0 |
0.000 |
25 |
|
Y |
23 |
9 |
11242 |
◊ |
H |
x,y-1,z |
1_545 |
20 |
7 |
11021 |
190.5 |
-3.2 |
0.254 |
0 |
0 |
0 |
0.000 |
Average: |
205.5 |
-3.3 |
0.262 |
1 |
0 |
0 |
0.000 |
11 |
26 |
|
X |
18 |
9 |
11017 |
◊ |
K |
x-1/2,y-1/2,z |
3_445 |
19 |
7 |
11028 |
162.2 |
-1.9 |
0.454 |
1 |
0 |
0 |
0.000 |
27 |
|
X |
20 |
7 |
11017 |
◊ |
H |
x,y-1,z |
1_545 |
15 |
6 |
11021 |
148.8 |
-1.7 |
0.453 |
1 |
0 |
0 |
0.000 |
28 |
|
H |
19 |
7 |
11021 |
◊ |
K |
x-1/2,y+1/2,z |
3_455 |
13 |
5 |
11028 |
145.6 |
-1.7 |
0.430 |
1 |
0 |
0 |
0.000 |
Average: |
152.2 |
-1.8 |
0.446 |
1 |
0 |
0 |
0.000 |
12 |
29 |
|
Y |
19 |
8 |
11242 |
◊ |
M |
x-1/2,y-1/2,z |
3_445 |
18 |
6 |
11233 |
157.8 |
-0.9 |
0.533 |
1 |
1 |
0 |
0.000 |
30 |
|
Y |
18 |
6 |
11242 |
◊ |
L |
x,y-1,z |
1_545 |
20 |
8 |
11246 |
150.1 |
-0.9 |
0.529 |
1 |
1 |
0 |
0.000 |
31 |
|
L |
18 |
6 |
11246 |
◊ |
M |
x-1/2,y+1/2,z |
3_455 |
18 |
7 |
11233 |
145.2 |
-1.0 |
0.506 |
1 |
1 |
0 |
0.000 |
Average: |
151.0 |
-0.9 |
0.523 |
1 |
1 |
0 |
0.000 |
13 |
32 |
|
K |
24 |
9 |
11028 |
◊ |
C |
-x+1,y,-z+1 |
2_656 |
16 |
4 |
7605 |
149.7 |
-1.2 |
0.487 |
0 |
0 |
0 |
0.000 |
14 |
33 |
|
M |
13 |
2 |
11233 |
◊ |
X |
-x+1,y,-z+1 |
2_656 |
19 |
8 |
11017 |
132.1 |
-0.4 |
0.596 |
0 |
0 |
0 |
0.000 |
15 |
34 |
|
Y |
13 |
3 |
11242 |
◊ |
H |
-x+1/2,y-1/2,-z+1 |
4_546 |
12 |
5 |
11021 |
103.4 |
0.7 |
0.775 |
1 |
0 |
0 |
0.000 |
16 |
35 |
|
X |
3 |
1 |
11017 |
◊ |
L |
x,y-1,z |
1_545 |
5 |
3 |
11246 |
42.9 |
0.4 |
0.734 |
1 |
0 |
0 |
0.000 |
36 |
|
H |
3 |
1 |
11021 |
◊ |
M |
x-1/2,y+1/2,z |
3_455 |
5 |
3 |
11233 |
42.1 |
0.4 |
0.723 |
1 |
0 |
0 |
0.000 |
37 |
|
Y |
5 |
3 |
11242 |
◊ |
K |
x-1/2,y-1/2,z |
3_445 |
3 |
1 |
11028 |
41.1 |
0.4 |
0.725 |
1 |
0 |
0 |
0.000 |
Average: |
42.0 |
0.4 |
0.727 |
1 |
0 |
0 |
0.000 |
17 |
38 |
|
[ZN]K:499 |
1 |
1 |
98 |
f |
K |
x,y,z |
1_555 |
5 |
3 |
11028 |
41.4 |
-23.0 |
0.000 |
0 |
0 |
0 |
0.338 |
39 |
|
[ZN]H:498 |
1 |
1 |
98 |
f |
H |
x,y,z |
1_555 |
7 |
4 |
11021 |
40.6 |
-21.2 |
0.000 |
0 |
0 |
0 |
0.338 |
40 |
|
[ZN]X:500 |
1 |
1 |
98 |
f |
X |
x,y,z |
1_555 |
5 |
3 |
11017 |
40.6 |
-21.6 |
0.000 |
0 |
0 |
0 |
0.338 |
Average: |
40.8 |
-21.9 |
0.000 |
0 |
0 |
0 |
0.338 |
18 |
41 |
|
[ZN]H:498 |
1 |
1 |
98 |
◊ |
L |
x,y,z |
1_555 |
6 |
3 |
11246 |
37.1 |
-17.3 |
0.000 |
0 |
0 |
0 |
0.255 |
42 |
|
[ZN]X:500 |
1 |
1 |
98 |
◊ |
Y |
x,y,z |
1_555 |
6 |
3 |
11242 |
36.6 |
-16.9 |
0.000 |
0 |
0 |
0 |
0.255 |
43 |
|
[ZN]K:499 |
1 |
1 |
98 |
◊ |
M |
x,y,z |
1_555 |
6 |
3 |
11233 |
34.2 |
-15.6 |
0.000 |
0 |
0 |
0 |
0.255 |
Average: |
36.0 |
-16.6 |
0.000 |
0 |
0 |
0 |
0.255 |
19 |
44 |
|
M |
5 |
1 |
11233 |
◊ |
C |
x,y,z |
1_555 |
5 |
1 |
7605 |
28.1 |
0.4 |
0.725 |
0 |
0 |
0 |
0.000 |
45 |
|
L |
3 |
1 |
11246 |
◊ |
B |
x,y,z |
1_555 |
5 |
1 |
7618 |
26.0 |
0.3 |
0.704 |
0 |
0 |
0 |
0.000 |
46 |
|
Y |
3 |
1 |
11242 |
◊ |
A |
x,y,z |
1_555 |
5 |
1 |
7594 |
25.7 |
0.4 |
0.730 |
0 |
0 |
0 |
0.000 |
Average: |
26.6 |
0.3 |
0.720 |
0 |
0 |
0 |
0.000 |
20 |
47 |
|
K |
2 |
1 |
11028 |
◊ |
K |
-x+1,y,-z+1 |
2_656 |
2 |
1 |
11028 |
17.2 |
-0.3 |
0.366 |
0 |
0 |
0 |
0.000 |
21 |
48 |
|
K |
1 |
1 |
11028 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
1 |
1 |
7594 |
5.9 |
-0.0 |
0.501 |
0 |
0 |
0 |
0.000 |
22 |
49 |
|
H |
1 |
1 |
11021 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
7618 |
2.7 |
0.1 |
0.782 |
0 |
0 |
0 |
0.000 |
50 |
|
K |
1 |
1 |
11028 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
7605 |
1.3 |
0.1 |
0.734 |
0 |
0 |
0 |
0.000 |
51 |
|
X |
1 |
1 |
11017 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
7594 |
0.9 |
0.1 |
0.717 |
0 |
0 |
0 |
0.000 |
Average: |
1.6 |
0.1 |
0.744 |
0 |
0 |
0 |
0.000 |
|