## |
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 |
|
F |
117 |
37 |
17733 |
◊ |
E |
x,y,z |
1_555 |
114 |
37 |
17691 |
1099.5 |
-6.8 |
0.503 |
20 |
9 |
0 |
0.223 |
2 |
|
I |
104 |
35 |
17790 |
◊ |
I |
-x+1,-y,z |
2_655 |
104 |
35 |
17790 |
1055.0 |
-6.3 |
0.490 |
19 |
12 |
0 |
0.223 |
3 |
|
B |
101 |
35 |
17755 |
◊ |
A |
x,y,z |
1_555 |
111 |
35 |
17217 |
1007.6 |
-7.9 |
0.393 |
15 |
8 |
0 |
0.223 |
Average: |
1054.1 |
-7.0 |
0.462 |
18 |
10 |
0 |
0.223 |
2 |
4 |
|
E |
72 |
20 |
17691 |
◊ |
I |
x,y,z-1 |
1_554 |
72 |
20 |
17790 |
797.4 |
-16.4 |
0.012 |
4 |
0 |
0 |
0.500 |
5 |
|
A |
77 |
21 |
17217 |
◊ |
A |
-x,-y,z |
2_555 |
77 |
21 |
17217 |
787.7 |
-15.5 |
0.024 |
4 |
0 |
0 |
0.500 |
6 |
|
B |
69 |
20 |
17755 |
◊ |
F |
x-1/2,-y-1/2,-z-1 |
4_444 |
72 |
21 |
17733 |
770.9 |
-15.7 |
0.016 |
4 |
0 |
0 |
0.500 |
Average: |
785.3 |
-15.9 |
0.017 |
4 |
0 |
0 |
0.500 |
3 |
7 |
|
I |
77 |
23 |
17790 |
◊ |
A |
-x+1/2,y-1/2,-z |
3_545 |
80 |
24 |
17217 |
719.9 |
-1.5 |
0.717 |
7 |
5 |
0 |
0.000 |
8 |
|
B |
77 |
25 |
17755 |
◊ |
E |
-x+1/2,y-1/2,-z-1 |
3_544 |
78 |
24 |
17691 |
691.5 |
-1.4 |
0.723 |
6 |
2 |
0 |
0.000 |
9 |
|
F |
71 |
22 |
17733 |
◊ |
F |
-x+1,-y-1,z |
2_645 |
69 |
22 |
17733 |
642.4 |
-0.9 |
0.743 |
6 |
2 |
0 |
0.000 |
Average: |
684.6 |
-1.3 |
0.728 |
6 |
3 |
0 |
0.000 |
4 |
10 |
|
B |
57 |
17 |
17755 |
◊ |
H |
x-1/2,-y-1/2,-z-1 |
4_444 |
48 |
13 |
4887 |
519.7 |
-6.3 |
0.204 |
5 |
0 |
0 |
0.281 |
11 |
|
D |
48 |
13 |
4894 |
◊ |
F |
x-1/2,-y-1/2,-z-1 |
4_444 |
59 |
17 |
17733 |
501.0 |
-6.6 |
0.189 |
5 |
0 |
0 |
0.281 |
12 |
|
E |
57 |
18 |
17691 |
◊ |
J |
x,y,z-1 |
1_554 |
50 |
13 |
4885 |
497.3 |
-6.2 |
0.206 |
5 |
0 |
0 |
0.281 |
13 |
|
C |
49 |
13 |
4888 |
◊ |
A |
-x,-y,z |
2_555 |
57 |
16 |
17217 |
494.1 |
-6.7 |
0.179 |
5 |
0 |
0 |
0.281 |
14 |
|
G |
48 |
13 |
4895 |
◊ |
I |
x,y,z-1 |
1_554 |
58 |
17 |
17790 |
490.4 |
-6.4 |
0.195 |
5 |
0 |
0 |
0.281 |
Average: |
500.5 |
-6.4 |
0.195 |
5 |
0 |
0 |
0.281 |
5 |
15 |
|
J |
49 |
12 |
4885 |
◊ |
I |
-x+1,-y,z |
2_655 |
58 |
14 |
17790 |
509.4 |
-3.8 |
0.365 |
10 |
5 |
0 |
0.224 |
16 |
|
G |
47 |
12 |
4895 |
◊ |
F |
x,y,z |
1_555 |
63 |
14 |
17733 |
506.4 |
-3.8 |
0.373 |
10 |
5 |
0 |
0.224 |
17 |
|
D |
47 |
12 |
4894 |
◊ |
A |
x,y,z |
1_555 |
62 |
14 |
17217 |
502.8 |
-4.2 |
0.342 |
9 |
4 |
0 |
0.224 |
18 |
|
C |
43 |
12 |
4888 |
◊ |
B |
x,y,z |
1_555 |
58 |
15 |
17755 |
493.2 |
-4.3 |
0.323 |
10 |
5 |
0 |
0.224 |
19 |
|
H |
44 |
12 |
4887 |
◊ |
E |
x,y,z |
1_555 |
58 |
14 |
17691 |
491.4 |
-4.5 |
0.310 |
11 |
5 |
0 |
0.224 |
Average: |
500.7 |
-4.1 |
0.342 |
10 |
5 |
0 |
0.224 |
6 |
20 |
|
C |
38 |
13 |
4888 |
◊ |
A |
x,y,z |
1_555 |
48 |
18 |
17217 |
358.4 |
-3.0 |
0.356 |
2 |
0 |
0 |
0.116 |
21 |
|
H |
35 |
11 |
4887 |
◊ |
F |
x,y,z |
1_555 |
40 |
15 |
17733 |
358.4 |
-2.6 |
0.366 |
2 |
0 |
0 |
0.116 |
22 |
|
J |
38 |
11 |
4885 |
◊ |
I |
x,y,z |
1_555 |
40 |
15 |
17790 |
352.5 |
-2.6 |
0.360 |
2 |
0 |
0 |
0.116 |
23 |
|
D |
37 |
11 |
4894 |
◊ |
B |
x,y,z |
1_555 |
40 |
14 |
17755 |
350.9 |
-2.8 |
0.342 |
2 |
0 |
0 |
0.116 |
24 |
|
G |
36 |
11 |
4895 |
◊ |
E |
x,y,z |
1_555 |
41 |
14 |
17691 |
349.4 |
-2.8 |
0.352 |
2 |
0 |
0 |
0.116 |
Average: |
353.9 |
-2.7 |
0.355 |
2 |
0 |
0 |
0.116 |
7 |
25 |
|
F |
28 |
11 |
17733 |
◊ |
E |
-x+1/2,y-1/2,-z-1 |
3_544 |
44 |
13 |
17691 |
314.3 |
-0.2 |
0.613 |
1 |
0 |
0 |
0.000 |
26 |
|
B |
27 |
9 |
17755 |
◊ |
A |
-x+1/2,y-1/2,-z |
3_545 |
37 |
12 |
17217 |
294.1 |
-0.6 |
0.547 |
5 |
1 |
0 |
0.000 |
Average: |
304.2 |
-0.4 |
0.580 |
3 |
1 |
0 |
0.000 |
8 |
27 |
|
I |
33 |
12 |
17790 |
◊ |
B |
x,y,z |
1_555 |
34 |
8 |
17755 |
269.9 |
-3.1 |
0.375 |
2 |
1 |
0 |
0.000 |
28 |
|
F |
34 |
9 |
17733 |
◊ |
B |
x,y,z |
1_555 |
33 |
14 |
17755 |
267.3 |
0.8 |
0.746 |
4 |
3 |
0 |
0.000 |
Average: |
268.6 |
-1.2 |
0.560 |
3 |
2 |
0 |
0.000 |
9 |
29 |
|
H |
15 |
4 |
4887 |
◊ |
E |
-x+1,-y,z |
2_655 |
16 |
5 |
17691 |
137.8 |
0.4 |
0.622 |
2 |
4 |
0 |
0.000 |
30 |
|
C |
12 |
4 |
4888 |
◊ |
I |
x-1/2,-y-1/2,-z |
4_445 |
14 |
4 |
17790 |
125.3 |
0.5 |
0.634 |
2 |
3 |
0 |
0.000 |
31 |
|
G |
15 |
4 |
4895 |
◊ |
A |
-x+1/2,y-1/2,-z-1 |
3_544 |
16 |
4 |
17217 |
124.9 |
0.4 |
0.631 |
1 |
4 |
0 |
0.000 |
32 |
|
B |
12 |
4 |
17755 |
◊ |
J |
-x+1/2,y-1/2,-z |
3_545 |
12 |
4 |
4885 |
117.0 |
0.6 |
0.642 |
2 |
3 |
0 |
0.000 |
33 |
|
F |
12 |
4 |
17733 |
◊ |
D |
-x+1/2,y-1/2,-z-1 |
3_544 |
13 |
4 |
4894 |
111.2 |
0.7 |
0.624 |
2 |
3 |
0 |
0.000 |
Average: |
123.3 |
0.5 |
0.631 |
2 |
3 |
0 |
0.000 |
10 |
34 |
|
[PO4]B:363 |
5 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
25 |
12 |
17755 |
110.6 |
-6.8 |
0.698 |
5 |
0 |
0 |
0.250 |
11 |
35 |
|
[PO4]F:363 |
5 |
1 |
188 |
f |
F |
x,y,z |
1_555 |
21 |
12 |
17733 |
110.3 |
-7.4 |
0.688 |
5 |
0 |
0 |
0.266 |
12 |
36 |
|
[PO4]E:364 |
5 |
1 |
188 |
f |
E |
x,y,z |
1_555 |
23 |
11 |
17691 |
109.0 |
-6.6 |
0.685 |
5 |
0 |
0 |
0.243 |
13 |
37 |
|
[PO4]A:365 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
21 |
11 |
17217 |
105.0 |
-6.7 |
0.691 |
6 |
0 |
0 |
0.327 |
14 |
38 |
|
[PO4]I:364 |
5 |
1 |
187 |
f |
I |
x,y,z |
1_555 |
19 |
10 |
17790 |
102.4 |
-6.7 |
0.670 |
6 |
0 |
0 |
0.257 |
15 |
39 |
|
[PO4]D:7 |
4 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
15 |
8 |
17217 |
89.7 |
-5.2 |
0.681 |
1 |
0 |
0 |
0.197 |
16 |
40 |
|
[PO4]A:364 |
4 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
13 |
4 |
17217 |
76.3 |
-4.5 |
0.698 |
1 |
0 |
0 |
0.174 |
17 |
41 |
|
[PO4]A:364 |
4 |
1 |
187 |
◊ |
B |
x,y,z |
1_555 |
11 |
4 |
17755 |
61.0 |
-3.4 |
0.750 |
0 |
0 |
0 |
0.038 |
18 |
42 |
|
[ZN]I:363 |
1 |
1 |
98 |
x |
I |
x,y,z |
1_555 |
4 |
3 |
17790 |
45.9 |
-28.3 |
0.000 |
0 |
0 |
0 |
0.616 |
43 |
|
[ZN]A:363 |
1 |
1 |
98 |
x |
A |
x,y,z |
1_555 |
4 |
3 |
17217 |
35.4 |
-20.5 |
0.000 |
0 |
0 |
0 |
0.616 |
44 |
|
[ZN]A:363 |
1 |
1 |
98 |
x |
B |
x,y,z |
1_555 |
4 |
4 |
17755 |
35.3 |
-20.3 |
0.000 |
0 |
0 |
0 |
0.616 |
45 |
|
[ZN]E:363 |
1 |
1 |
98 |
x |
E |
x,y,z |
1_555 |
2 |
2 |
17691 |
35.1 |
-20.4 |
0.000 |
0 |
0 |
0 |
0.616 |
46 |
|
[ZN]E:363 |
1 |
1 |
98 |
x |
F |
x,y,z |
1_555 |
4 |
3 |
17733 |
35.0 |
-20.4 |
0.000 |
0 |
0 |
0 |
0.616 |
Average: |
37.3 |
-22.0 |
0.000 |
0 |
0 |
0 |
0.616 |
19 |
47 |
|
E |
4 |
1 |
17691 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
17755 |
42.7 |
-0.1 |
0.392 |
0 |
0 |
0 |
0.000 |
48 |
|
I |
2 |
1 |
17790 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
17217 |
9.0 |
-0.2 |
0.431 |
0 |
0 |
0 |
0.000 |
Average: |
25.9 |
-0.2 |
0.411 |
0 |
0 |
0 |
0.000 |
20 |
49 |
|
[PO4]D:7 |
4 |
1 |
188 |
◊ |
D |
x,y,z |
1_555 |
5 |
1 |
4894 |
39.1 |
-1.8 |
0.848 |
0 |
0 |
0 |
0.045 |
21 |
50 |
|
[PO4]E:364 |
4 |
1 |
188 |
◊ |
G |
x,y,z |
1_555 |
3 |
1 |
4895 |
25.9 |
-0.8 |
0.881 |
0 |
0 |
0 |
0.013 |
22 |
51 |
|
[PO4]A:365 |
4 |
1 |
187 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
4888 |
23.5 |
-0.6 |
0.880 |
0 |
0 |
0 |
0.015 |
23 |
52 |
|
[PO4]B:363 |
4 |
1 |
188 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
4894 |
22.4 |
-0.6 |
0.872 |
0 |
0 |
0 |
0.010 |
24 |
53 |
|
[PO4]F:363 |
4 |
1 |
188 |
◊ |
H |
x,y,z |
1_555 |
3 |
1 |
4887 |
20.9 |
-0.6 |
0.872 |
0 |
0 |
0 |
0.009 |
25 |
54 |
|
[PO4]I:364 |
4 |
1 |
187 |
◊ |
J |
x,y,z |
1_555 |
3 |
1 |
4885 |
20.0 |
-0.5 |
0.868 |
0 |
0 |
0 |
0.009 |
26 |
55 |
|
[PO4]A:365 |
1 |
1 |
187 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
17755 |
2.0 |
-0.1 |
0.606 |
0 |
0 |
0 |
0.002 |
|