## |
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 |
194 |
45 |
14747 |
◊ |
A |
x,y,z |
1_555 |
194 |
45 |
14804 |
1777.2 |
-32.3 |
0.002 |
19 |
0 |
0 |
0.447 |
2 |
|
D |
181 |
41 |
14646 |
◊ |
C |
x,y,z |
1_555 |
178 |
43 |
14579 |
1656.1 |
-30.3 |
0.003 |
19 |
0 |
0 |
0.447 |
Average: |
1716.7 |
-31.3 |
0.002 |
19 |
0 |
0 |
0.447 |
2 |
3 |
|
A |
64 |
19 |
14804 |
◊ |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
59 |
22 |
14747 |
598.9 |
2.3 |
0.723 |
11 |
3 |
0 |
0.000 |
3 |
4 |
|
[NAD]B:402 |
42 |
1 |
829 |
f |
B |
x,y,z |
1_555 |
87 |
34 |
14747 |
588.9 |
-9.9 |
0.341 |
8 |
0 |
0 |
0.339 |
5 |
|
[NAD]A:402 |
35 |
1 |
743 |
f |
A |
x,y,z |
1_555 |
77 |
32 |
14804 |
524.0 |
-8.2 |
0.307 |
8 |
0 |
0 |
0.339 |
6 |
|
[NAD]C:402 |
34 |
1 |
743 |
f |
C |
x,y,z |
1_555 |
73 |
32 |
14579 |
519.4 |
-7.7 |
0.331 |
6 |
0 |
0 |
0.339 |
7 |
|
[NAD]D:402 |
25 |
1 |
573 |
f |
D |
x,y,z |
1_555 |
58 |
22 |
14646 |
393.9 |
-4.3 |
0.347 |
7 |
0 |
0 |
0.339 |
Average: |
506.5 |
-7.5 |
0.331 |
7 |
0 |
0 |
0.339 |
4 |
8 |
|
C |
46 |
15 |
14579 |
◊ |
A |
x,y,z |
1_555 |
48 |
14 |
14804 |
387.5 |
-2.0 |
0.491 |
4 |
2 |
0 |
0.063 |
9 |
|
D |
47 |
15 |
14646 |
◊ |
B |
x,y,z |
1_555 |
45 |
13 |
14747 |
383.4 |
-3.1 |
0.370 |
2 |
1 |
0 |
0.063 |
Average: |
385.4 |
-2.6 |
0.430 |
3 |
2 |
0 |
0.063 |
5 |
10 |
|
[TYD]B:401 |
24 |
1 |
512 |
f |
B |
x,y,z |
1_555 |
44 |
16 |
14747 |
382.1 |
-8.3 |
0.704 |
12 |
0 |
0 |
0.439 |
11 |
|
[TYD]C:401 |
24 |
1 |
511 |
f |
C |
x,y,z |
1_555 |
45 |
17 |
14579 |
377.5 |
-8.1 |
0.710 |
13 |
0 |
0 |
0.439 |
12 |
|
[TYD]A:401 |
23 |
1 |
507 |
f |
A |
x,y,z |
1_555 |
46 |
16 |
14804 |
376.0 |
-8.1 |
0.704 |
12 |
0 |
0 |
0.439 |
13 |
|
[TYD]D:401 |
24 |
1 |
506 |
f |
D |
x,y,z |
1_555 |
45 |
16 |
14646 |
373.3 |
-10.1 |
0.588 |
14 |
0 |
0 |
0.439 |
Average: |
377.2 |
-8.7 |
0.676 |
13 |
0 |
0 |
0.439 |
6 |
14 |
|
A |
43 |
11 |
14804 |
◊ |
C |
-x+1/2,-y+1,z-1/2 |
2_564 |
36 |
12 |
14579 |
351.8 |
-0.7 |
0.551 |
4 |
1 |
0 |
0.000 |
7 |
15 |
|
D |
36 |
12 |
14646 |
◊ |
B |
-x+1/2,-y+1,z-1/2 |
2_564 |
37 |
9 |
14747 |
348.6 |
-0.7 |
0.560 |
4 |
1 |
0 |
0.000 |
8 |
16 |
|
C |
37 |
13 |
14579 |
◊ |
B |
x-1/2,-y+3/2,-z+1 |
4_466 |
39 |
12 |
14747 |
342.3 |
-1.9 |
0.479 |
4 |
0 |
0 |
0.000 |
9 |
17 |
|
A |
31 |
9 |
14804 |
x |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
20 |
7 |
14804 |
217.2 |
-3.6 |
0.188 |
1 |
0 |
0 |
0.000 |
10 |
18 |
|
A |
12 |
7 |
14804 |
◊ |
D |
-x,y-1/2,-z+1/2 |
3_545 |
12 |
5 |
14646 |
93.6 |
1.5 |
0.837 |
1 |
2 |
0 |
0.000 |
11 |
19 |
|
C |
13 |
5 |
14579 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
9 |
4 |
14804 |
86.7 |
-1.3 |
0.346 |
0 |
1 |
0 |
0.000 |
12 |
20 |
|
B |
8 |
2 |
14747 |
◊ |
C |
-x+1/2,-y+1,z-1/2 |
2_564 |
9 |
3 |
14579 |
80.8 |
1.0 |
0.751 |
1 |
0 |
0 |
0.000 |
13 |
21 |
|
D |
8 |
2 |
14646 |
◊ |
A |
-x+1/2,-y+1,z-1/2 |
2_564 |
5 |
3 |
14804 |
64.7 |
0.7 |
0.716 |
0 |
0 |
0 |
0.000 |
14 |
22 |
|
D |
10 |
5 |
14646 |
◊ |
C |
-x+1/2,-y+1,z-1/2 |
2_564 |
9 |
3 |
14579 |
53.8 |
0.5 |
0.726 |
1 |
0 |
0 |
0.000 |
15 |
23 |
|
[NI]B:403 |
1 |
1 |
115 |
◊ |
B |
x,y,z |
1_555 |
8 |
4 |
14747 |
49.5 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.196 |
24 |
|
[NI]C:403 |
1 |
1 |
115 |
◊ |
A |
x,y,z |
1_555 |
8 |
5 |
14804 |
46.2 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.196 |
25 |
|
[NI]B:403 |
1 |
1 |
115 |
◊ |
D |
x,y,z |
1_555 |
8 |
3 |
14646 |
42.8 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.196 |
26 |
|
[NI]C:403 |
1 |
1 |
115 |
◊ |
C |
x,y,z |
1_555 |
6 |
2 |
14579 |
41.7 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.196 |
Average: |
45.0 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.196 |
16 |
27 |
|
C |
4 |
2 |
14579 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
14747 |
15.2 |
0.3 |
0.713 |
0 |
0 |
0 |
0.000 |
28 |
|
D |
1 |
1 |
14646 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
14804 |
3.6 |
0.3 |
0.846 |
0 |
0 |
0 |
0.000 |
Average: |
9.4 |
0.3 |
0.779 |
0 |
0 |
0 |
0.000 |
17 |
29 |
|
A |
1 |
1 |
14804 |
◊ |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
1 |
1 |
14747 |
4.7 |
0.0 |
0.503 |
0 |
0 |
0 |
0.000 |
18 |
30 |
|
D |
1 |
1 |
14646 |
◊ |
B |
x-1,y,z |
1_455 |
1 |
1 |
14747 |
3.6 |
0.1 |
0.764 |
0 |
0 |
0 |
0.000 |
19 |
31 |
|
D |
1 |
1 |
14646 |
◊ |
C |
x-1/2,-y+3/2,-z+1 |
4_466 |
1 |
1 |
14579 |
0.4 |
-0.0 |
0.615 |
0 |
0 |
0 |
0.000 |
|