## |
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 |
109 |
27 |
7170 |
◊ |
A |
x,y,z |
1_555 |
100 |
26 |
14032 |
1001.0 |
-13.7 |
0.079 |
11 |
0 |
0 |
0.866 |
2 |
|
F |
103 |
25 |
7284 |
◊ |
D |
x,y,z |
1_555 |
104 |
27 |
13998 |
988.2 |
-11.7 |
0.147 |
13 |
0 |
0 |
0.866 |
3 |
|
G |
104 |
26 |
7268 |
◊ |
C |
x,y,z |
1_555 |
103 |
27 |
13960 |
987.4 |
-12.4 |
0.122 |
11 |
0 |
0 |
0.866 |
4 |
|
H |
103 |
26 |
7233 |
◊ |
B |
x,y,z |
1_555 |
99 |
26 |
14079 |
985.9 |
-13.1 |
0.096 |
12 |
0 |
0 |
0.866 |
Average: |
990.6 |
-12.7 |
0.111 |
12 |
0 |
0 |
0.866 |
2 |
5 |
|
F |
103 |
35 |
7284 |
◊ |
J |
x,y,z |
1_555 |
62 |
9 |
1492 |
818.9 |
-10.2 |
0.645 |
17 |
2 |
0 |
1.000 |
3 |
6 |
|
G |
104 |
34 |
7268 |
◊ |
I |
x,y,z |
1_555 |
59 |
8 |
1314 |
812.3 |
-9.0 |
0.692 |
14 |
1 |
0 |
1.000 |
7 |
|
E |
101 |
34 |
7170 |
◊ |
K |
x,y,z |
1_555 |
59 |
8 |
1303 |
793.8 |
-9.2 |
0.642 |
17 |
0 |
0 |
1.000 |
8 |
|
H |
105 |
33 |
7233 |
◊ |
L |
x,y,z |
1_555 |
58 |
8 |
1283 |
791.5 |
-9.2 |
0.678 |
19 |
0 |
0 |
1.000 |
Average: |
799.2 |
-9.1 |
0.671 |
17 |
0 |
0 |
1.000 |
4 |
9 |
|
D |
77 |
24 |
13998 |
◊ |
A |
x,y,z |
1_555 |
74 |
21 |
14032 |
730.4 |
1.6 |
0.753 |
13 |
2 |
0 |
0.055 |
10 |
|
C |
73 |
22 |
13960 |
◊ |
B |
x,y,z |
1_555 |
66 |
22 |
14079 |
692.7 |
2.8 |
0.843 |
11 |
6 |
0 |
0.055 |
Average: |
711.6 |
2.2 |
0.798 |
12 |
4 |
0 |
0.055 |
5 |
11 |
|
B |
77 |
18 |
14079 |
◊ |
A |
x,y,z |
1_555 |
77 |
20 |
14032 |
686.0 |
-4.4 |
0.383 |
6 |
4 |
0 |
0.125 |
12 |
|
D |
74 |
17 |
13998 |
◊ |
C |
x,y,z |
1_555 |
79 |
20 |
13960 |
683.2 |
-4.5 |
0.395 |
11 |
3 |
0 |
0.125 |
Average: |
684.6 |
-4.4 |
0.389 |
9 |
4 |
0 |
0.125 |
6 |
13 |
|
E |
76 |
20 |
7170 |
◊ |
D |
x-y,x+1,z-1/6 |
2_564 |
78 |
26 |
13998 |
679.5 |
-5.6 |
0.372 |
6 |
2 |
0 |
0.247 |
14 |
|
B |
73 |
25 |
14079 |
◊ |
G |
x-y+1,x+1,z-1/6 |
2_664 |
71 |
20 |
7268 |
659.4 |
-6.5 |
0.281 |
6 |
2 |
0 |
0.247 |
15 |
|
A |
66 |
22 |
14032 |
◊ |
F |
x-y,x+1,z-1/6 |
2_564 |
70 |
21 |
7284 |
644.0 |
-6.1 |
0.286 |
3 |
1 |
0 |
0.247 |
16 |
|
H |
60 |
20 |
7233 |
◊ |
C |
x-y+1,x+1,z-1/6 |
2_664 |
59 |
21 |
13960 |
569.8 |
-7.3 |
0.185 |
3 |
0 |
0 |
0.247 |
Average: |
638.2 |
-6.4 |
0.281 |
5 |
1 |
0 |
0.247 |
7 |
17 |
|
A |
49 |
18 |
14032 |
◊ |
C |
x-y,x,z-1/6 |
2_554 |
59 |
17 |
13960 |
454.8 |
-1.9 |
0.497 |
4 |
5 |
0 |
0.000 |
8 |
18 |
|
E |
51 |
17 |
7170 |
◊ |
G |
-y,x-y+1,z-1/3 |
3_564 |
51 |
17 |
7268 |
427.7 |
-0.8 |
0.710 |
6 |
0 |
0 |
0.000 |
9 |
19 |
|
C |
44 |
12 |
13960 |
◊ |
A |
x,y,z |
1_555 |
55 |
16 |
14032 |
407.8 |
-4.5 |
0.245 |
3 |
1 |
0 |
0.043 |
10 |
20 |
|
[IZA]A:2001 |
22 |
1 |
489 |
f |
A |
x,y,z |
1_555 |
50 |
20 |
14032 |
367.2 |
-1.7 |
0.258 |
4 |
0 |
0 |
0.158 |
21 |
|
[IZA]C:1201 |
22 |
1 |
490 |
f |
C |
x,y,z |
1_555 |
50 |
20 |
13960 |
365.5 |
-1.3 |
0.296 |
3 |
0 |
0 |
0.158 |
22 |
|
[IZA]D:1201 |
22 |
1 |
489 |
f |
D |
x,y,z |
1_555 |
49 |
20 |
13998 |
358.2 |
-1.4 |
0.303 |
3 |
0 |
0 |
0.158 |
23 |
|
[IZA]B:1201 |
22 |
1 |
490 |
f |
B |
x,y,z |
1_555 |
49 |
20 |
14079 |
357.9 |
-1.7 |
0.268 |
4 |
0 |
0 |
0.158 |
Average: |
362.2 |
-1.5 |
0.281 |
4 |
0 |
0 |
0.158 |
11 |
24 |
|
H |
18 |
7 |
7233 |
◊ |
F |
-y,x-y+1,z-1/3 |
3_564 |
21 |
7 |
7284 |
176.2 |
2.4 |
0.901 |
0 |
0 |
0 |
0.000 |
12 |
25 |
|
D |
17 |
6 |
13998 |
◊ |
F |
x-y,x+1,z-1/6 |
2_564 |
18 |
6 |
7284 |
136.4 |
-2.0 |
0.309 |
1 |
0 |
0 |
0.018 |
13 |
26 |
|
H |
11 |
5 |
7233 |
◊ |
B |
x-y+1,x+1,z-1/6 |
2_664 |
13 |
6 |
14079 |
105.6 |
-1.7 |
0.298 |
1 |
0 |
0 |
0.015 |
14 |
27 |
|
A |
7 |
3 |
14032 |
◊ |
G |
-y,x-y+1,z-1/3 |
3_564 |
15 |
6 |
7268 |
99.2 |
1.8 |
0.805 |
1 |
2 |
0 |
0.000 |
28 |
|
E |
8 |
4 |
7170 |
◊ |
C |
-y,x-y+1,z-1/3 |
3_564 |
6 |
2 |
13960 |
70.8 |
1.4 |
0.862 |
1 |
2 |
0 |
0.000 |
Average: |
85.0 |
1.6 |
0.833 |
1 |
2 |
0 |
0.000 |
15 |
29 |
|
C |
8 |
4 |
13960 |
◊ |
G |
x-y+1,x+1,z-1/6 |
2_664 |
7 |
3 |
7268 |
79.9 |
-0.6 |
0.462 |
1 |
0 |
0 |
0.012 |
30 |
|
E |
6 |
3 |
7170 |
◊ |
A |
x-y,x+1,z-1/6 |
2_564 |
8 |
4 |
14032 |
74.2 |
-0.6 |
0.441 |
0 |
0 |
0 |
0.012 |
Average: |
77.1 |
-0.6 |
0.452 |
1 |
0 |
0 |
0.012 |
16 |
31 |
|
[PO4]B:1202 |
5 |
1 |
188 |
f |
C |
x,y,z |
1_555 |
12 |
5 |
13960 |
77.2 |
-4.0 |
0.732 |
1 |
0 |
0 |
0.182 |
17 |
32 |
|
E |
7 |
4 |
7170 |
◊ |
F |
x-y,x+1,z-1/6 |
2_564 |
7 |
4 |
7284 |
73.4 |
-2.3 |
0.111 |
0 |
0 |
0 |
0.024 |
33 |
|
H |
6 |
3 |
7233 |
◊ |
G |
x-y+1,x+1,z-1/6 |
2_664 |
7 |
4 |
7268 |
65.3 |
-1.9 |
0.141 |
0 |
0 |
0 |
0.024 |
Average: |
69.3 |
-2.1 |
0.126 |
0 |
0 |
0 |
0.024 |
18 |
34 |
|
[PO4]B:1202 |
4 |
1 |
188 |
◊ |
B |
x,y,z |
1_555 |
14 |
7 |
14079 |
66.3 |
-3.0 |
0.881 |
2 |
0 |
0 |
0.046 |
19 |
35 |
|
B |
4 |
1 |
14079 |
◊ |
C |
x-y+1,x+1,z-1/6 |
2_664 |
4 |
2 |
13960 |
24.5 |
-0.3 |
0.480 |
0 |
0 |
0 |
0.003 |
36 |
|
A |
4 |
1 |
14032 |
◊ |
D |
x-y,x+1,z-1/6 |
2_564 |
3 |
2 |
13998 |
21.7 |
-0.3 |
0.447 |
0 |
0 |
0 |
0.003 |
Average: |
23.1 |
-0.3 |
0.463 |
0 |
0 |
0 |
0.003 |
20 |
37 |
|
E |
2 |
2 |
7170 |
◊ |
J |
x-y,x+1,z-1/6 |
2_564 |
2 |
1 |
1492 |
12.8 |
0.3 |
0.781 |
0 |
0 |
0 |
0.000 |
21 |
38 |
|
K |
1 |
1 |
1303 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
14032 |
7.9 |
-0.3 |
0.435 |
0 |
0 |
0 |
0.008 |
39 |
|
I |
1 |
1 |
1314 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
13960 |
4.8 |
-0.2 |
0.505 |
0 |
0 |
0 |
0.008 |
40 |
|
L |
1 |
1 |
1283 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
14079 |
2.5 |
-0.1 |
0.532 |
0 |
0 |
0 |
0.008 |
Average: |
5.1 |
-0.2 |
0.491 |
0 |
0 |
0 |
0.008 |
22 |
41 |
|
[IZA]B:1201 |
1 |
1 |
490 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
13960 |
7.1 |
0.4 |
0.642 |
0 |
0 |
0 |
0.000 |
23 |
42 |
|
J |
1 |
1 |
1492 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
13998 |
2.7 |
-0.1 |
0.545 |
0 |
0 |
0 |
0.002 |
24 |
43 |
|
[IZA]D:1201 |
1 |
1 |
489 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
14032 |
2.0 |
0.1 |
0.537 |
0 |
0 |
0 |
0.000 |
|