| ## |
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 |
|
E |
118 |
33 |
7747 |
◊ |
A |
x,y,z |
1_555 |
102 |
27 |
7751 |
1086.9 |
-12.0 |
0.226 |
8 |
5 |
0 |
0.490 |
2 |
|
D |
105 |
27 |
7749 |
◊ |
C |
x,y,z |
1_555 |
118 |
33 |
7759 |
1083.8 |
-11.8 |
0.229 |
8 |
5 |
0 |
0.490 |
3 |
|
C |
103 |
27 |
7759 |
◊ |
B |
x,y,z |
1_555 |
118 |
34 |
7770 |
1082.3 |
-11.6 |
0.239 |
8 |
5 |
0 |
0.490 |
4 |
|
B |
103 |
27 |
7770 |
◊ |
A |
x,y,z |
1_555 |
118 |
34 |
7751 |
1074.0 |
-11.7 |
0.241 |
9 |
6 |
0 |
0.490 |
5 |
|
E |
104 |
27 |
7747 |
◊ |
D |
x,y,z |
1_555 |
119 |
33 |
7749 |
1067.7 |
-11.6 |
0.244 |
9 |
6 |
0 |
0.490 |
| Average: |
1078.9 |
-11.7 |
0.236 |
8 |
5 |
0 |
0.490 |
| 2 |
6 |
|
B |
39 |
10 |
7770 |
◊ |
E |
-x+3/2,y-1/2,-z+1/2 |
7_645 |
33 |
9 |
7747 |
319.2 |
-4.5 |
0.324 |
3 |
0 |
0 |
0.000 |
| 3 |
7 |
|
[RBF]D:303 |
27 |
1 |
543 |
f |
D |
x,y,z |
1_555 |
41 |
14 |
7749 |
272.9 |
-0.6 |
0.469 |
7 |
0 |
0 |
0.112 |
8 |
|
[RBF]A:300 |
27 |
1 |
546 |
f |
A |
x,y,z |
1_555 |
41 |
14 |
7751 |
271.0 |
-0.6 |
0.475 |
7 |
0 |
0 |
0.112 |
9 |
|
[RBF]B:301 |
27 |
1 |
543 |
f |
B |
x,y,z |
1_555 |
41 |
14 |
7770 |
270.9 |
-0.6 |
0.482 |
7 |
0 |
0 |
0.112 |
10 |
|
[RBF]C:302 |
27 |
1 |
542 |
f |
C |
x,y,z |
1_555 |
41 |
14 |
7759 |
270.7 |
-0.6 |
0.483 |
7 |
0 |
0 |
0.112 |
11 |
|
[RBF]E:304 |
26 |
1 |
539 |
f |
E |
x,y,z |
1_555 |
41 |
14 |
7747 |
270.0 |
-0.7 |
0.484 |
7 |
0 |
0 |
0.112 |
| Average: |
271.1 |
-0.6 |
0.479 |
7 |
0 |
0 |
0.112 |
| 4 |
12 |
|
C |
30 |
8 |
7759 |
◊ |
A |
-x+3/2,-y+1/2,z-1/2 |
6_654 |
33 |
10 |
7751 |
271.0 |
-3.1 |
0.414 |
1 |
2 |
0 |
0.000 |
| 5 |
13 |
|
[RBF]A:300 |
12 |
1 |
546 |
◊ |
E |
x,y,z |
1_555 |
18 |
9 |
7747 |
153.5 |
-1.7 |
0.359 |
2 |
0 |
0 |
0.072 |
14 |
|
[RBF]C:302 |
11 |
1 |
542 |
◊ |
B |
x,y,z |
1_555 |
19 |
9 |
7770 |
153.0 |
-1.7 |
0.355 |
1 |
0 |
0 |
0.072 |
15 |
|
[RBF]B:301 |
11 |
1 |
543 |
◊ |
A |
x,y,z |
1_555 |
19 |
9 |
7751 |
152.9 |
-1.7 |
0.357 |
2 |
0 |
0 |
0.072 |
16 |
|
[RBF]E:304 |
11 |
1 |
539 |
◊ |
D |
x,y,z |
1_555 |
20 |
9 |
7749 |
152.4 |
-1.7 |
0.360 |
1 |
0 |
0 |
0.072 |
17 |
|
[RBF]D:303 |
11 |
1 |
543 |
◊ |
C |
x,y,z |
1_555 |
19 |
9 |
7759 |
151.8 |
-1.6 |
0.352 |
2 |
0 |
0 |
0.072 |
| Average: |
152.7 |
-1.7 |
0.357 |
2 |
0 |
0 |
0.072 |
| 6 |
18 |
|
D |
20 |
6 |
7749 |
◊ |
A |
-x+1,y,-z+1/2 |
3_655 |
19 |
6 |
7751 |
149.3 |
0.1 |
0.716 |
4 |
0 |
0 |
0.024 |
19 |
|
C |
21 |
6 |
7759 |
◊ |
B |
-x+1,y,-z+1/2 |
3_655 |
20 |
6 |
7770 |
149.1 |
0.1 |
0.709 |
4 |
0 |
0 |
0.024 |
20 |
|
E |
20 |
6 |
7747 |
◊ |
E |
-x+1,y,-z+1/2 |
3_655 |
20 |
6 |
7747 |
144.2 |
0.1 |
0.714 |
4 |
0 |
0 |
0.024 |
| Average: |
147.5 |
0.1 |
0.713 |
4 |
0 |
0 |
0.024 |
| 7 |
21 |
|
C |
14 |
4 |
7759 |
◊ |
A |
-x+1,y,-z+1/2 |
3_655 |
13 |
4 |
7751 |
104.2 |
-0.6 |
0.595 |
2 |
0 |
0 |
0.018 |
22 |
|
B |
12 |
4 |
7770 |
◊ |
B |
-x+1,y,-z+1/2 |
3_655 |
12 |
4 |
7770 |
100.1 |
-0.6 |
0.583 |
2 |
0 |
0 |
0.018 |
23 |
|
E |
13 |
4 |
7747 |
◊ |
D |
-x+1,y,-z+1/2 |
3_655 |
11 |
4 |
7749 |
99.8 |
-0.5 |
0.591 |
1 |
0 |
0 |
0.018 |
| Average: |
101.4 |
-0.6 |
0.590 |
2 |
0 |
0 |
0.018 |
| 8 |
24 |
|
[PO4]E:503 |
5 |
1 |
188 |
f |
E |
x,y,z |
1_555 |
15 |
6 |
7747 |
84.6 |
-5.4 |
0.685 |
4 |
0 |
0 |
0.213 |
25 |
|
[PO4]B:500 |
5 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
7770 |
84.6 |
-5.4 |
0.682 |
4 |
0 |
0 |
0.213 |
26 |
|
[PO4]C:501 |
5 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
15 |
6 |
7759 |
83.0 |
-5.3 |
0.681 |
4 |
0 |
0 |
0.213 |
27 |
|
[PO4]D:502 |
5 |
1 |
187 |
f |
D |
x,y,z |
1_555 |
14 |
6 |
7749 |
82.2 |
-5.3 |
0.676 |
4 |
0 |
0 |
0.213 |
28 |
|
[PO4]A:504 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
7751 |
82.1 |
-5.2 |
0.678 |
4 |
0 |
0 |
0.213 |
| Average: |
83.3 |
-5.3 |
0.680 |
4 |
0 |
0 |
0.213 |
| 9 |
29 |
|
D |
11 |
3 |
7749 |
◊ |
A |
-x+3/2,-y+1/2,z-1/2 |
6_654 |
12 |
3 |
7751 |
83.4 |
0.6 |
0.764 |
1 |
3 |
0 |
0.000 |
| 10 |
30 |
|
[RBF]D:303 |
3 |
1 |
543 |
f |
[PO4]D:502 |
x,y,z |
1_555 |
3 |
1 |
187 |
42.9 |
-2.0 |
0.678 |
0 |
0 |
0 |
0.060 |
31 |
|
[RBF]A:300 |
3 |
1 |
546 |
f |
[PO4]A:504 |
x,y,z |
1_555 |
3 |
1 |
187 |
42.8 |
-2.0 |
0.683 |
0 |
0 |
0 |
0.060 |
32 |
|
[RBF]C:302 |
3 |
1 |
542 |
f |
[PO4]C:501 |
x,y,z |
1_555 |
3 |
1 |
187 |
42.1 |
-2.0 |
0.681 |
0 |
0 |
0 |
0.060 |
33 |
|
[RBF]E:304 |
3 |
1 |
539 |
f |
[PO4]E:503 |
x,y,z |
1_555 |
3 |
1 |
188 |
40.9 |
-2.0 |
0.685 |
0 |
0 |
0 |
0.060 |
34 |
|
[RBF]B:301 |
3 |
1 |
543 |
f |
[PO4]B:500 |
x,y,z |
1_555 |
3 |
1 |
188 |
40.6 |
-1.9 |
0.681 |
0 |
0 |
0 |
0.060 |
| Average: |
41.9 |
-2.0 |
0.682 |
0 |
0 |
0 |
0.060 |
| 11 |
35 |
|
[PO4]A:504 |
4 |
1 |
187 |
◊ |
E |
x,y,z |
1_555 |
4 |
2 |
7747 |
41.2 |
-1.1 |
0.958 |
2 |
0 |
0 |
0.059 |
36 |
|
[PO4]D:502 |
4 |
1 |
187 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
7759 |
41.2 |
-1.1 |
0.958 |
2 |
0 |
0 |
0.059 |
37 |
|
[PO4]C:501 |
4 |
1 |
187 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
7770 |
40.6 |
-1.1 |
0.957 |
2 |
0 |
0 |
0.059 |
38 |
|
[PO4]B:500 |
4 |
1 |
188 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
7751 |
40.4 |
-1.0 |
0.958 |
2 |
0 |
0 |
0.059 |
39 |
|
[PO4]E:503 |
4 |
1 |
188 |
◊ |
D |
x,y,z |
1_555 |
4 |
2 |
7749 |
40.0 |
-1.1 |
0.958 |
2 |
0 |
0 |
0.059 |
| Average: |
40.7 |
-1.1 |
0.958 |
2 |
0 |
0 |
0.059 |
| 12 |
40 |
|
C |
3 |
2 |
7759 |
◊ |
E |
-x+3/2,-y+1/2,z-1/2 |
6_654 |
5 |
2 |
7747 |
31.0 |
1.0 |
0.872 |
0 |
0 |
0 |
0.000 |
| 13 |
41 |
|
D |
3 |
1 |
7749 |
◊ |
B |
-x+1,y,-z+1/2 |
3_655 |
3 |
1 |
7770 |
21.9 |
-0.3 |
0.500 |
0 |
0 |
0 |
0.004 |
42 |
|
E |
3 |
1 |
7747 |
◊ |
A |
-x+1,y,-z+1/2 |
3_655 |
3 |
1 |
7751 |
21.4 |
-0.3 |
0.490 |
0 |
0 |
0 |
0.004 |
43 |
|
C |
3 |
1 |
7759 |
◊ |
C |
-x+1,y,-z+1/2 |
3_655 |
3 |
1 |
7759 |
20.9 |
-0.3 |
0.507 |
0 |
0 |
0 |
0.004 |
| Average: |
21.4 |
-0.3 |
0.499 |
0 |
0 |
0 |
0.004 |
| 14 |
44 |
|
E |
1 |
1 |
7747 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
7759 |
6.4 |
0.2 |
0.830 |
0 |
0 |
0 |
0.000 |
45 |
|
C |
1 |
1 |
7759 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
7751 |
5.8 |
0.2 |
0.823 |
0 |
0 |
0 |
0.000 |
46 |
|
E |
1 |
1 |
7747 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
7770 |
5.6 |
0.2 |
0.822 |
0 |
0 |
0 |
0.000 |
47 |
|
D |
1 |
1 |
7749 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
7770 |
5.6 |
0.2 |
0.822 |
0 |
0 |
0 |
0.000 |
48 |
|
D |
1 |
1 |
7749 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
7751 |
5.3 |
0.2 |
0.817 |
0 |
0 |
0 |
0.000 |
| Average: |
5.8 |
0.2 |
0.823 |
0 |
0 |
0 |
0.000 |
|