| ## |
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 |
516 |
125 |
17574 |
◊ |
A |
x,y,z |
1_555 |
506 |
127 |
17418 |
4773.3 |
-63.7 |
0.002 |
51 |
0 |
0 |
0.822 |
2 |
|
D |
520 |
125 |
17465 |
◊ |
C |
x,y,z |
1_555 |
514 |
125 |
17436 |
4749.4 |
-65.7 |
0.002 |
52 |
1 |
0 |
0.822 |
| Average: |
4761.3 |
-64.7 |
0.002 |
52 |
1 |
0 |
0.822 |
| 2 |
3 |
|
A |
42 |
12 |
17418 |
◊ |
C |
x-1/2,y-1/2,z |
3_445 |
49 |
14 |
17436 |
362.3 |
-3.7 |
0.373 |
0 |
0 |
0 |
0.000 |
4 |
|
B |
40 |
11 |
17574 |
◊ |
B |
-x,y,-z |
2_555 |
42 |
12 |
17574 |
327.4 |
-3.7 |
0.338 |
0 |
0 |
0 |
0.000 |
| Average: |
344.9 |
-3.7 |
0.356 |
0 |
0 |
0 |
0.000 |
| 3 |
5 |
|
B |
32 |
7 |
17574 |
◊ |
C |
-x+1/2,y-1/2,-z |
4_545 |
37 |
9 |
17436 |
300.6 |
-1.1 |
0.584 |
0 |
0 |
0 |
0.000 |
| 4 |
6 |
|
B |
32 |
8 |
17574 |
◊ |
B |
-x,y,-z+1 |
2_556 |
32 |
8 |
17574 |
269.5 |
-3.6 |
0.276 |
2 |
0 |
0 |
0.012 |
7 |
|
C |
30 |
8 |
17436 |
◊ |
A |
x,y,z |
1_555 |
30 |
9 |
17418 |
266.0 |
-4.2 |
0.208 |
2 |
0 |
0 |
0.012 |
| Average: |
267.8 |
-3.9 |
0.242 |
2 |
0 |
0 |
0.012 |
| 5 |
8 |
|
[PLP]B:1403 |
16 |
1 |
393 |
◊ |
B |
x,y,z |
1_555 |
41 |
15 |
17574 |
243.8 |
0.7 |
0.672 |
4 |
0 |
0 |
0.023 |
9 |
|
[PLP]C:1403 |
16 |
1 |
391 |
◊ |
C |
x,y,z |
1_555 |
41 |
15 |
17436 |
233.4 |
0.0 |
0.596 |
3 |
0 |
0 |
0.023 |
10 |
|
[PLP]A:1403 |
16 |
1 |
391 |
◊ |
A |
x,y,z |
1_555 |
37 |
14 |
17418 |
233.0 |
0.3 |
0.609 |
4 |
0 |
0 |
0.023 |
11 |
|
[PLP]D:1403 |
16 |
1 |
385 |
◊ |
D |
x,y,z |
1_555 |
39 |
16 |
17465 |
232.9 |
0.1 |
0.590 |
3 |
0 |
0 |
0.023 |
| Average: |
235.8 |
0.3 |
0.617 |
4 |
0 |
0 |
0.023 |
| 6 |
12 |
|
B |
26 |
6 |
17574 |
◊ |
A |
-x,y,-z+1 |
2_556 |
25 |
11 |
17418 |
229.0 |
-0.4 |
0.617 |
2 |
2 |
0 |
0.000 |
13 |
|
C |
22 |
8 |
17436 |
◊ |
B |
x,y,z |
1_555 |
23 |
11 |
17574 |
212.3 |
-1.1 |
0.523 |
0 |
0 |
0 |
0.000 |
14 |
|
D |
17 |
9 |
17465 |
◊ |
A |
x,y,z |
1_555 |
19 |
7 |
17418 |
167.4 |
-0.5 |
0.607 |
1 |
0 |
0 |
0.000 |
| Average: |
202.9 |
-0.7 |
0.582 |
1 |
1 |
0 |
0.000 |
| 7 |
15 |
|
D |
21 |
9 |
17465 |
◊ |
A |
-x,y,-z+1 |
2_556 |
20 |
10 |
17418 |
191.9 |
-3.3 |
0.198 |
0 |
0 |
0 |
0.000 |
| 8 |
16 |
|
B |
14 |
4 |
17574 |
◊ |
A |
-x,y,-z |
2_555 |
11 |
3 |
17418 |
110.5 |
1.0 |
0.730 |
1 |
0 |
0 |
0.000 |
17 |
|
A |
15 |
4 |
17418 |
◊ |
D |
x-1/2,y-1/2,z |
3_445 |
11 |
4 |
17465 |
110.3 |
1.0 |
0.776 |
1 |
0 |
0 |
0.000 |
18 |
|
B |
9 |
3 |
17574 |
◊ |
C |
x-1/2,y-1/2,z |
3_445 |
15 |
4 |
17436 |
108.6 |
0.6 |
0.735 |
2 |
0 |
0 |
0.000 |
| Average: |
109.8 |
0.8 |
0.747 |
1 |
0 |
0 |
0.000 |
| 9 |
19 |
|
D |
12 |
4 |
17465 |
◊ |
B |
x,y,z |
1_555 |
12 |
4 |
17574 |
93.8 |
0.2 |
0.682 |
1 |
0 |
0 |
0.000 |
20 |
|
A |
9 |
3 |
17418 |
◊ |
A |
-x,y,-z+1 |
2_556 |
9 |
3 |
17418 |
77.3 |
0.0 |
0.665 |
0 |
0 |
0 |
0.000 |
| Average: |
85.6 |
0.1 |
0.673 |
1 |
0 |
0 |
0.000 |
| 10 |
21 |
|
[PLP]A:1403 |
7 |
1 |
391 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
17574 |
78.2 |
-3.1 |
0.355 |
1 |
0 |
0 |
0.100 |
22 |
|
[PLP]B:1403 |
7 |
1 |
393 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
17418 |
76.7 |
-2.9 |
0.393 |
2 |
0 |
0 |
0.100 |
23 |
|
[PLP]D:1403 |
7 |
1 |
385 |
f |
C |
x,y,z |
1_555 |
11 |
5 |
17436 |
74.4 |
-2.8 |
0.378 |
2 |
0 |
0 |
0.100 |
24 |
|
[PLP]C:1403 |
6 |
1 |
391 |
f |
D |
x,y,z |
1_555 |
11 |
4 |
17465 |
74.3 |
-2.8 |
0.359 |
2 |
0 |
0 |
0.100 |
| Average: |
75.9 |
-2.9 |
0.371 |
2 |
0 |
0 |
0.100 |
| 11 |
25 |
|
[NA]B:1404 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
10 |
6 |
17574 |
62.3 |
-9.6 |
0.000 |
0 |
0 |
0 |
0.091 |
26 |
|
[NA]C:1404 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
9 |
6 |
17436 |
61.6 |
-9.4 |
0.000 |
0 |
0 |
0 |
0.091 |
| Average: |
61.9 |
-9.5 |
0.000 |
0 |
0 |
0 |
0.091 |
| 12 |
27 |
|
[MG]B:1999 |
1 |
1 |
98 |
x |
B |
x,y,z |
1_555 |
8 |
4 |
17574 |
31.6 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.018 |
| 13 |
28 |
|
[MG]B:1999 |
1 |
1 |
98 |
x |
A |
x,y,z |
1_555 |
3 |
1 |
17418 |
10.8 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.000 |
|