| ## |
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 |
96 |
27 |
12676 |
◊ |
B |
x,y,z |
1_555 |
108 |
28 |
12072 |
967.5 |
-5.5 |
0.435 |
15 |
12 |
0 |
0.596 |
2 |
|
F |
104 |
27 |
12294 |
◊ |
D |
x,y,z |
1_555 |
91 |
25 |
12131 |
956.9 |
-5.4 |
0.375 |
14 |
11 |
0 |
0.596 |
3 |
|
E |
92 |
25 |
12547 |
◊ |
D |
x,y,z |
1_555 |
101 |
28 |
12131 |
955.6 |
-5.2 |
0.374 |
15 |
12 |
0 |
0.596 |
4 |
|
C |
103 |
27 |
12676 |
◊ |
A |
x,y,z |
1_555 |
88 |
26 |
12746 |
948.4 |
-4.4 |
0.456 |
16 |
13 |
0 |
0.596 |
5 |
|
F |
92 |
26 |
12294 |
◊ |
E |
x,y,z |
1_555 |
101 |
28 |
12547 |
936.0 |
-6.9 |
0.281 |
14 |
11 |
0 |
0.596 |
6 |
|
B |
81 |
23 |
12072 |
◊ |
A |
x,y,z |
1_555 |
101 |
28 |
12746 |
919.6 |
-5.5 |
0.387 |
15 |
12 |
0 |
0.596 |
| Average: |
947.3 |
-5.5 |
0.385 |
15 |
12 |
0 |
0.596 |
| 2 |
7 |
|
A |
59 |
18 |
12746 |
◊ |
E |
x,y,z-1 |
1_554 |
53 |
16 |
12547 |
562.2 |
-4.3 |
0.320 |
7 |
2 |
0 |
0.000 |
8 |
|
C |
43 |
14 |
12676 |
◊ |
F |
x-1,y,z-1 |
1_454 |
53 |
17 |
12294 |
472.4 |
-4.6 |
0.276 |
6 |
2 |
0 |
0.000 |
| Average: |
517.3 |
-4.5 |
0.298 |
7 |
2 |
0 |
0.000 |
| 3 |
9 |
|
F |
43 |
12 |
12294 |
◊ |
A |
x,y,z |
1_555 |
37 |
11 |
12746 |
342.3 |
0.2 |
0.700 |
2 |
0 |
0 |
0.000 |
10 |
|
D |
42 |
13 |
12131 |
◊ |
C |
x,y,z |
1_555 |
40 |
13 |
12676 |
339.8 |
1.5 |
0.806 |
3 |
0 |
0 |
0.000 |
11 |
|
E |
42 |
13 |
12547 |
◊ |
B |
x,y,z |
1_555 |
44 |
13 |
12072 |
321.3 |
1.6 |
0.809 |
2 |
0 |
0 |
0.000 |
| Average: |
334.5 |
1.1 |
0.771 |
2 |
0 |
0 |
0.000 |
| 4 |
12 |
|
A |
27 |
9 |
12746 |
◊ |
D |
-x-1,y-1/2,-z-1 |
2_444 |
35 |
13 |
12131 |
292.5 |
3.3 |
0.900 |
10 |
6 |
0 |
0.000 |
| 5 |
13 |
|
B |
28 |
9 |
12072 |
◊ |
D |
-x-1,y-1/2,-z-1 |
2_444 |
36 |
10 |
12131 |
236.4 |
-0.8 |
0.545 |
3 |
1 |
0 |
0.000 |
| 6 |
14 |
|
E |
20 |
8 |
12547 |
◊ |
F |
-x,y-1/2,-z |
2_545 |
21 |
7 |
12294 |
199.3 |
-1.4 |
0.430 |
3 |
1 |
0 |
0.000 |
| 7 |
15 |
|
[98T]B:402 |
12 |
1 |
362 |
f |
B |
x,y,z |
1_555 |
32 |
11 |
12072 |
184.8 |
-2.6 |
0.437 |
0 |
0 |
0 |
0.102 |
16 |
|
[98T]C:703 |
12 |
1 |
356 |
f |
A |
x,y,z |
1_555 |
30 |
12 |
12746 |
179.6 |
-2.2 |
0.456 |
0 |
0 |
0 |
0.102 |
17 |
|
[98T]D:503 |
12 |
1 |
359 |
f |
D |
x,y,z |
1_555 |
25 |
10 |
12131 |
177.2 |
-2.2 |
0.389 |
0 |
0 |
0 |
0.102 |
18 |
|
[98T]E:402 |
12 |
1 |
358 |
f |
F |
x,y,z |
1_555 |
29 |
10 |
12294 |
173.2 |
-2.4 |
0.411 |
0 |
0 |
0 |
0.102 |
19 |
|
[98T]D:502 |
12 |
1 |
359 |
f |
E |
x,y,z |
1_555 |
28 |
9 |
12547 |
172.6 |
-2.5 |
0.366 |
0 |
0 |
0 |
0.102 |
20 |
|
[98T]C:704 |
12 |
1 |
360 |
f |
C |
x,y,z |
1_555 |
30 |
12 |
12676 |
171.5 |
-2.3 |
0.437 |
0 |
0 |
0 |
0.102 |
| Average: |
176.5 |
-2.4 |
0.416 |
0 |
0 |
0 |
0.102 |
| 8 |
21 |
|
B |
20 |
9 |
12072 |
◊ |
A |
x-1,y,z |
1_455 |
24 |
7 |
12746 |
159.8 |
-1.0 |
0.474 |
3 |
0 |
0 |
0.000 |
| 9 |
22 |
|
B |
22 |
6 |
12072 |
◊ |
C |
-x-1,y-1/2,-z-1 |
2_444 |
22 |
8 |
12676 |
159.0 |
1.1 |
0.779 |
0 |
0 |
0 |
0.000 |
| 10 |
23 |
|
[98T]C:704 |
12 |
1 |
360 |
◊ |
B |
x,y,z |
1_555 |
25 |
6 |
12072 |
138.8 |
-2.4 |
0.440 |
0 |
0 |
0 |
0.030 |
24 |
|
[98T]E:402 |
12 |
1 |
358 |
◊ |
E |
x,y,z |
1_555 |
23 |
6 |
12547 |
135.8 |
-2.1 |
0.480 |
0 |
0 |
0 |
0.030 |
| Average: |
137.3 |
-2.2 |
0.460 |
0 |
0 |
0 |
0.030 |
| 11 |
25 |
|
[98T]D:502 |
12 |
1 |
359 |
◊ |
D |
x,y,z |
1_555 |
23 |
6 |
12131 |
138.7 |
-2.4 |
0.452 |
0 |
0 |
0 |
0.062 |
26 |
|
[98T]C:703 |
12 |
1 |
356 |
◊ |
C |
x,y,z |
1_555 |
21 |
5 |
12676 |
137.3 |
-2.3 |
0.448 |
0 |
0 |
0 |
0.062 |
27 |
|
[98T]D:503 |
12 |
1 |
359 |
◊ |
F |
x,y,z |
1_555 |
20 |
5 |
12294 |
136.8 |
-2.0 |
0.472 |
0 |
0 |
0 |
0.062 |
28 |
|
[98T]B:402 |
12 |
1 |
362 |
◊ |
A |
x,y,z |
1_555 |
22 |
5 |
12746 |
136.4 |
-2.3 |
0.449 |
0 |
0 |
0 |
0.062 |
| Average: |
137.3 |
-2.3 |
0.455 |
0 |
0 |
0 |
0.062 |
| 12 |
29 |
|
[PO4]B:401 |
5 |
1 |
189 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
12072 |
90.6 |
-6.5 |
0.523 |
3 |
0 |
0 |
0.089 |
| 13 |
30 |
|
B |
7 |
3 |
12072 |
◊ |
E |
x-1,y,z-1 |
1_454 |
12 |
4 |
12547 |
84.1 |
-0.4 |
0.358 |
1 |
0 |
0 |
0.000 |
| 14 |
31 |
|
[PO4]E:401 |
5 |
1 |
188 |
f |
E |
x,y,z |
1_555 |
13 |
6 |
12547 |
83.8 |
-5.8 |
0.559 |
3 |
0 |
0 |
0.102 |
| 15 |
32 |
|
[PO4]A:401 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
12746 |
83.4 |
-5.7 |
0.609 |
4 |
0 |
0 |
0.170 |
33 |
|
[PO4]C:701 |
5 |
1 |
188 |
f |
C |
x,y,z |
1_555 |
13 |
6 |
12676 |
82.5 |
-5.6 |
0.586 |
4 |
0 |
0 |
0.170 |
| Average: |
82.9 |
-5.7 |
0.597 |
4 |
0 |
0 |
0.170 |
| 16 |
34 |
|
[PO4]D:501 |
5 |
1 |
189 |
f |
D |
x,y,z |
1_555 |
11 |
6 |
12131 |
82.6 |
-5.8 |
0.561 |
4 |
0 |
0 |
0.108 |
| 17 |
35 |
|
[PO4]C:702 |
5 |
1 |
189 |
◊ |
B |
x,y,z |
1_555 |
11 |
4 |
12072 |
72.7 |
-3.7 |
0.814 |
1 |
0 |
0 |
0.047 |
| 18 |
36 |
|
[PO4]C:702 |
4 |
1 |
189 |
f |
C |
x,y,z |
1_555 |
11 |
4 |
12676 |
72.5 |
-3.9 |
0.768 |
2 |
0 |
0 |
0.055 |
| 19 |
37 |
|
E |
12 |
5 |
12547 |
◊ |
D |
-x-1,y-1/2,-z |
2_445 |
10 |
3 |
12131 |
65.3 |
0.0 |
0.622 |
0 |
0 |
0 |
0.000 |
| 20 |
38 |
|
E |
9 |
3 |
12547 |
◊ |
C |
-x-1,y-1/2,-z-1 |
2_444 |
9 |
3 |
12676 |
50.3 |
0.7 |
0.745 |
0 |
0 |
0 |
0.000 |
| 21 |
39 |
|
[PO4]B:401 |
3 |
1 |
189 |
◊ |
E |
x-1,y,z-1 |
1_454 |
3 |
1 |
12547 |
35.4 |
-1.7 |
0.764 |
1 |
0 |
0 |
0.000 |
| 22 |
40 |
|
E |
2 |
1 |
12547 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
12676 |
13.4 |
0.1 |
0.710 |
0 |
0 |
0 |
0.000 |
41 |
|
F |
1 |
1 |
12294 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
12072 |
3.4 |
0.1 |
0.762 |
0 |
0 |
0 |
0.000 |
42 |
|
D |
1 |
1 |
12131 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
12746 |
1.4 |
0.0 |
0.582 |
0 |
0 |
0 |
0.000 |
| Average: |
6.1 |
0.1 |
0.685 |
0 |
0 |
0 |
0.000 |
| 23 |
43 |
|
[98T]C:704 |
3 |
1 |
360 |
f |
[PO4]C:702 |
x,y,z |
1_555 |
1 |
1 |
189 |
8.2 |
-0.5 |
0.758 |
0 |
0 |
0 |
0.005 |
|