## |
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 |
|
D |
196 |
53 |
14787 |
◊ |
C |
x,y,z |
1_555 |
197 |
52 |
14965 |
1933.8 |
-29.5 |
0.024 |
30 |
17 |
0 |
0.523 |
2 |
|
B |
199 |
53 |
14818 |
◊ |
A |
x,y,z |
1_555 |
196 |
53 |
14830 |
1917.8 |
-29.9 |
0.026 |
33 |
19 |
0 |
0.523 |
Average: |
1925.8 |
-29.7 |
0.025 |
32 |
18 |
0 |
0.523 |
2 |
3 |
|
D |
143 |
39 |
14787 |
◊ |
A |
x,y,z |
1_555 |
144 |
40 |
14830 |
1310.9 |
-19.6 |
0.090 |
28 |
2 |
0 |
0.384 |
4 |
|
C |
140 |
39 |
14965 |
◊ |
B |
x,y,z |
1_555 |
144 |
41 |
14818 |
1300.7 |
-18.8 |
0.088 |
28 |
2 |
0 |
0.384 |
Average: |
1305.8 |
-19.2 |
0.089 |
28 |
2 |
0 |
0.384 |
3 |
5 |
|
[NAD]B:5464 |
43 |
1 |
831 |
f |
B |
x,y,z |
1_555 |
78 |
32 |
14818 |
550.3 |
-6.4 |
0.463 |
6 |
0 |
0 |
0.229 |
6 |
|
[NAD]D:5466 |
40 |
1 |
832 |
f |
D |
x,y,z |
1_555 |
75 |
30 |
14787 |
545.1 |
-6.3 |
0.439 |
7 |
0 |
0 |
0.229 |
7 |
|
[NAD]A:5463 |
40 |
1 |
831 |
f |
A |
x,y,z |
1_555 |
75 |
30 |
14830 |
541.8 |
-6.3 |
0.464 |
6 |
0 |
0 |
0.229 |
8 |
|
[NAD]C:5465 |
41 |
1 |
832 |
f |
C |
x,y,z |
1_555 |
77 |
31 |
14965 |
540.3 |
-6.2 |
0.453 |
8 |
0 |
0 |
0.229 |
Average: |
544.4 |
-6.3 |
0.455 |
7 |
0 |
0 |
0.229 |
4 |
9 |
|
B |
53 |
18 |
14818 |
◊ |
D |
-x+2,y-1/2,-z+1 |
2_746 |
48 |
17 |
14787 |
443.5 |
1.4 |
0.827 |
4 |
3 |
0 |
0.000 |
5 |
10 |
|
C |
53 |
16 |
14965 |
◊ |
A |
x,y,z |
1_555 |
54 |
16 |
14830 |
442.9 |
-1.0 |
0.709 |
5 |
0 |
0 |
0.025 |
11 |
|
D |
53 |
16 |
14787 |
◊ |
B |
x,y,z |
1_555 |
55 |
16 |
14818 |
435.9 |
-0.3 |
0.757 |
7 |
1 |
0 |
0.025 |
Average: |
439.4 |
-0.6 |
0.733 |
6 |
1 |
0 |
0.025 |
6 |
12 |
|
B |
43 |
15 |
14818 |
◊ |
D |
-x+2,y-1/2,-z |
2_745 |
41 |
15 |
14787 |
419.1 |
-3.3 |
0.439 |
1 |
2 |
0 |
0.000 |
7 |
13 |
|
C |
39 |
14 |
14965 |
◊ |
A |
x,y,z-1 |
1_554 |
31 |
12 |
14830 |
331.1 |
-2.1 |
0.520 |
4 |
1 |
0 |
0.000 |
8 |
14 |
|
A |
33 |
10 |
14830 |
◊ |
D |
x-1,y,z |
1_455 |
31 |
15 |
14787 |
262.8 |
-1.2 |
0.629 |
3 |
0 |
0 |
0.000 |
15 |
|
C |
33 |
16 |
14965 |
◊ |
B |
x-1,y,z |
1_455 |
28 |
9 |
14818 |
259.6 |
-1.0 |
0.621 |
3 |
0 |
0 |
0.000 |
Average: |
261.2 |
-1.1 |
0.625 |
3 |
0 |
0 |
0.000 |
9 |
16 |
|
[G3H]C:1339 |
10 |
1 |
302 |
f |
C |
x,y,z |
1_555 |
29 |
13 |
14965 |
168.5 |
-4.8 |
0.553 |
6 |
0 |
0 |
0.091 |
10 |
17 |
|
[G3H]A:1337 |
10 |
1 |
306 |
f |
A |
x,y,z |
1_555 |
25 |
12 |
14830 |
167.6 |
-5.2 |
0.491 |
6 |
0 |
0 |
0.093 |
11 |
18 |
|
[G3H]B:1338 |
10 |
1 |
294 |
f |
B |
x,y,z |
1_555 |
28 |
13 |
14818 |
166.0 |
-4.2 |
0.569 |
7 |
0 |
0 |
0.089 |
12 |
19 |
|
B |
18 |
7 |
14818 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
21 |
10 |
14830 |
160.6 |
0.8 |
0.773 |
1 |
0 |
0 |
0.000 |
13 |
20 |
|
[G3H]D:1340 |
9 |
1 |
309 |
f |
D |
x,y,z |
1_555 |
23 |
10 |
14787 |
140.8 |
-4.7 |
0.545 |
6 |
0 |
0 |
0.086 |
14 |
21 |
|
A |
21 |
10 |
14830 |
x |
A |
-x+1,y-1/2,-z+1 |
2_646 |
16 |
8 |
14830 |
129.3 |
-0.1 |
0.655 |
1 |
0 |
0 |
0.000 |
15 |
22 |
|
[GOL]B:340 |
6 |
1 |
217 |
f |
B |
x,y,z |
1_555 |
16 |
8 |
14818 |
99.4 |
-0.8 |
0.463 |
2 |
0 |
0 |
0.020 |
16 |
23 |
|
[GOL]C:340 |
5 |
1 |
220 |
f |
C |
x,y,z |
1_555 |
11 |
6 |
14965 |
89.9 |
0.6 |
0.692 |
0 |
0 |
0 |
0.000 |
17 |
24 |
|
[NAD]D:5466 |
12 |
1 |
832 |
f |
[G3H]D:1340 |
x,y,z |
1_555 |
6 |
1 |
309 |
85.6 |
-2.6 |
0.575 |
1 |
0 |
0 |
0.035 |
18 |
25 |
|
[GOL]C:340 |
6 |
1 |
220 |
f |
[NAD]C:5465 |
x,y,z |
1_555 |
6 |
1 |
832 |
72.5 |
-0.8 |
0.488 |
2 |
0 |
0 |
0.021 |
19 |
26 |
|
[NAD]A:5463 |
10 |
1 |
831 |
f |
[G3H]A:1337 |
x,y,z |
1_555 |
6 |
1 |
306 |
61.5 |
1.0 |
0.716 |
1 |
0 |
0 |
0.000 |
20 |
27 |
|
[NAD]B:5464 |
10 |
1 |
831 |
f |
[G3H]B:1338 |
x,y,z |
1_555 |
5 |
1 |
294 |
59.3 |
0.5 |
0.709 |
1 |
0 |
0 |
0.000 |
21 |
28 |
|
[NAD]C:5465 |
10 |
1 |
832 |
f |
[G3H]C:1339 |
x,y,z |
1_555 |
4 |
1 |
302 |
58.3 |
0.7 |
0.713 |
1 |
0 |
0 |
0.000 |
22 |
29 |
|
[MG]B:341 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
11 |
7 |
14818 |
56.5 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.107 |
23 |
30 |
|
[NAD]D:5466 |
8 |
1 |
832 |
◊ |
A |
x,y,z |
1_555 |
5 |
4 |
14830 |
50.7 |
-2.9 |
0.243 |
0 |
0 |
0 |
0.066 |
31 |
|
[NAD]B:5464 |
7 |
1 |
831 |
◊ |
C |
x,y,z |
1_555 |
5 |
4 |
14965 |
47.2 |
-2.7 |
0.243 |
0 |
0 |
0 |
0.066 |
32 |
|
[NAD]A:5463 |
7 |
1 |
831 |
◊ |
D |
x,y,z |
1_555 |
5 |
4 |
14787 |
47.0 |
-2.7 |
0.243 |
0 |
0 |
0 |
0.066 |
33 |
|
[NAD]C:5465 |
7 |
1 |
832 |
◊ |
B |
x,y,z |
1_555 |
5 |
4 |
14818 |
46.0 |
-2.7 |
0.234 |
0 |
0 |
0 |
0.066 |
Average: |
47.7 |
-2.8 |
0.241 |
0 |
0 |
0 |
0.066 |
24 |
34 |
|
D |
8 |
4 |
14787 |
◊ |
A |
x,y,z-1 |
1_554 |
6 |
2 |
14830 |
50.2 |
-0.1 |
0.583 |
0 |
0 |
0 |
0.000 |
25 |
35 |
|
[MG]D:340 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
9 |
6 |
14787 |
44.1 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.070 |
26 |
36 |
|
[GOL]B:340 |
5 |
1 |
217 |
◊ |
D |
x,y,z |
1_555 |
5 |
2 |
14787 |
41.0 |
0.3 |
0.711 |
0 |
0 |
0 |
0.000 |
27 |
37 |
|
C |
8 |
6 |
14965 |
◊ |
D |
x-1,y,z |
1_455 |
8 |
4 |
14787 |
40.6 |
0.9 |
0.816 |
0 |
0 |
0 |
0.000 |
28 |
38 |
|
[MG]D:340 |
1 |
1 |
98 |
f |
[G3H]D:1340 |
x,y,z |
1_555 |
5 |
1 |
309 |
34.1 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.060 |
29 |
39 |
|
[GOL]C:340 |
4 |
1 |
220 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
14818 |
30.3 |
-0.4 |
0.329 |
0 |
0 |
0 |
0.004 |
30 |
40 |
|
C |
3 |
2 |
14965 |
x |
C |
-x+1,y-1/2,-z |
2_645 |
3 |
2 |
14965 |
30.3 |
0.9 |
0.886 |
1 |
1 |
0 |
0.000 |
31 |
41 |
|
B |
3 |
2 |
14818 |
◊ |
A |
-x+2,y-1/2,-z+1 |
2_746 |
2 |
1 |
14830 |
11.7 |
-0.1 |
0.590 |
0 |
0 |
0 |
0.000 |
32 |
42 |
|
C |
1 |
1 |
14965 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
1 |
1 |
14830 |
1.9 |
-0.1 |
0.463 |
0 |
0 |
0 |
0.000 |
|