## |
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 |
|
D |
99 |
24 |
6806 |
◊ |
C |
x,y,z |
1_555 |
99 |
25 |
5902 |
1108.4 |
-16.0 |
0.127 |
9 |
11 |
0 |
1.000 |
2 |
|
H |
101 |
24 |
6510 |
◊ |
G |
x,y,z |
1_555 |
99 |
24 |
5917 |
1101.5 |
-15.0 |
0.202 |
10 |
12 |
0 |
1.000 |
Average: |
1105.0 |
-15.5 |
0.164 |
10 |
12 |
0 |
1.000 |
2 |
3 |
|
B |
96 |
20 |
4526 |
◊ |
A |
x,y,z |
1_555 |
98 |
20 |
4549 |
906.1 |
-8.6 |
0.745 |
42 |
0 |
0 |
1.000 |
4 |
|
F |
96 |
20 |
4508 |
◊ |
E |
x,y,z |
1_555 |
97 |
20 |
4563 |
904.9 |
-7.6 |
0.764 |
44 |
0 |
0 |
1.000 |
Average: |
905.5 |
-8.1 |
0.755 |
43 |
0 |
0 |
1.000 |
3 |
5 |
|
H |
85 |
25 |
6510 |
◊ |
D |
x,y,z |
1_555 |
83 |
24 |
6806 |
849.3 |
-8.0 |
0.366 |
6 |
6 |
0 |
0.232 |
4 |
6 |
|
B |
62 |
9 |
4526 |
◊ |
D |
x,y,z |
1_555 |
58 |
14 |
6806 |
555.0 |
-1.2 |
0.705 |
11 |
0 |
0 |
0.159 |
5 |
7 |
|
F |
60 |
9 |
4508 |
◊ |
H |
x,y,z |
1_555 |
55 |
13 |
6510 |
544.6 |
-2.1 |
0.691 |
12 |
0 |
0 |
0.180 |
6 |
8 |
|
A |
54 |
11 |
4549 |
◊ |
D |
x,y,z |
1_555 |
49 |
14 |
6806 |
442.3 |
-1.5 |
0.750 |
7 |
0 |
0 |
0.070 |
9 |
|
E |
47 |
9 |
4563 |
◊ |
H |
x,y,z |
1_555 |
42 |
13 |
6510 |
398.5 |
-2.9 |
0.695 |
6 |
0 |
0 |
0.070 |
Average: |
420.4 |
-2.2 |
0.722 |
7 |
0 |
0 |
0.070 |
7 |
10 |
|
G |
37 |
10 |
5917 |
◊ |
C |
-x+1/2,-y+1,z-1/2 |
2_564 |
38 |
12 |
5902 |
382.3 |
-3.8 |
0.488 |
4 |
2 |
0 |
0.000 |
8 |
11 |
|
C |
39 |
12 |
5902 |
◊ |
G |
-x,y-1/2,-z+1/2 |
3_545 |
40 |
11 |
5917 |
371.8 |
-4.5 |
0.446 |
3 |
0 |
0 |
0.000 |
9 |
12 |
|
F |
34 |
5 |
4508 |
◊ |
G |
x,y,z |
1_555 |
37 |
11 |
5917 |
326.0 |
-8.2 |
0.312 |
10 |
0 |
0 |
1.000 |
10 |
13 |
|
E |
33 |
7 |
4563 |
◊ |
G |
x,y,z |
1_555 |
26 |
7 |
5917 |
277.1 |
-2.5 |
0.657 |
5 |
0 |
0 |
0.060 |
14 |
|
A |
26 |
7 |
4549 |
◊ |
C |
x,y,z |
1_555 |
22 |
7 |
5902 |
231.9 |
-0.5 |
0.711 |
5 |
0 |
0 |
0.060 |
Average: |
254.5 |
-1.5 |
0.684 |
5 |
0 |
0 |
0.060 |
11 |
15 |
|
B |
27 |
5 |
4526 |
◊ |
C |
x,y,z |
1_555 |
31 |
10 |
5902 |
258.2 |
-7.3 |
0.282 |
7 |
0 |
0 |
1.000 |
12 |
16 |
|
E |
21 |
2 |
4563 |
◊ |
C |
x,y,z |
1_555 |
23 |
5 |
5902 |
170.1 |
0.7 |
0.726 |
2 |
0 |
0 |
0.001 |
17 |
|
A |
20 |
2 |
4549 |
◊ |
G |
x,y,z |
1_555 |
23 |
5 |
5917 |
165.8 |
0.8 |
0.751 |
2 |
0 |
0 |
0.001 |
Average: |
167.9 |
0.7 |
0.738 |
2 |
0 |
0 |
0.001 |
13 |
18 |
|
A |
16 |
4 |
4549 |
◊ |
D |
-x+1/2,-y+1,z-1/2 |
2_564 |
17 |
4 |
6806 |
141.9 |
-3.5 |
0.390 |
2 |
0 |
0 |
0.000 |
14 |
19 |
|
F |
16 |
2 |
4508 |
◊ |
C |
x,y,z |
1_555 |
21 |
5 |
5902 |
141.8 |
-0.3 |
0.640 |
0 |
0 |
0 |
0.004 |
20 |
|
B |
14 |
2 |
4526 |
◊ |
G |
x,y,z |
1_555 |
19 |
4 |
5917 |
125.0 |
0.2 |
0.689 |
1 |
0 |
0 |
0.004 |
Average: |
133.4 |
-0.0 |
0.664 |
1 |
0 |
0 |
0.004 |
15 |
21 |
|
E |
14 |
3 |
4563 |
◊ |
H |
-x,y-1/2,-z+1/2 |
3_545 |
17 |
4 |
6510 |
130.7 |
-6.0 |
0.220 |
1 |
0 |
0 |
0.000 |
16 |
22 |
|
D |
16 |
3 |
6806 |
◊ |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
15 |
2 |
4526 |
119.7 |
0.9 |
0.596 |
0 |
0 |
0 |
0.000 |
23 |
|
F |
16 |
1 |
4508 |
◊ |
H |
x-1/2,-y+3/2,-z |
4_465 |
14 |
3 |
6510 |
107.4 |
0.5 |
0.585 |
0 |
0 |
0 |
0.000 |
Average: |
113.6 |
0.7 |
0.591 |
0 |
0 |
0 |
0.000 |
17 |
24 |
|
E |
16 |
4 |
4563 |
◊ |
G |
x-1/2,-y+3/2,-z |
4_465 |
15 |
5 |
5917 |
112.1 |
0.5 |
0.754 |
3 |
0 |
0 |
0.000 |
18 |
25 |
|
C |
13 |
4 |
5902 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
13 |
2 |
4549 |
111.8 |
1.4 |
0.800 |
2 |
0 |
0 |
0.000 |
19 |
26 |
|
A |
10 |
2 |
4549 |
◊ |
H |
x,y,z |
1_555 |
12 |
3 |
6510 |
88.0 |
-0.3 |
0.626 |
1 |
0 |
0 |
0.005 |
27 |
|
E |
10 |
2 |
4563 |
◊ |
D |
x,y,z |
1_555 |
12 |
3 |
6806 |
84.1 |
-0.2 |
0.616 |
0 |
0 |
0 |
0.005 |
Average: |
86.1 |
-0.2 |
0.621 |
1 |
0 |
0 |
0.005 |
20 |
28 |
|
C |
7 |
3 |
5902 |
◊ |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
10 |
2 |
4526 |
86.1 |
0.7 |
0.719 |
2 |
0 |
0 |
0.000 |
29 |
|
F |
9 |
2 |
4508 |
◊ |
G |
x-1/2,-y+3/2,-z |
4_465 |
8 |
4 |
5917 |
80.1 |
0.0 |
0.623 |
2 |
0 |
0 |
0.000 |
Average: |
83.1 |
0.4 |
0.671 |
2 |
0 |
0 |
0.000 |
21 |
30 |
|
E |
8 |
3 |
4563 |
◊ |
G |
-x,y-1/2,-z+1/2 |
3_545 |
7 |
3 |
5917 |
66.0 |
0.5 |
0.719 |
0 |
0 |
0 |
0.000 |
22 |
31 |
|
H |
5 |
3 |
6510 |
◊ |
C |
x,y,z |
1_555 |
6 |
2 |
5902 |
50.7 |
0.6 |
0.640 |
1 |
0 |
0 |
0.000 |
32 |
|
D |
5 |
3 |
6806 |
◊ |
G |
x,y,z |
1_555 |
4 |
1 |
5917 |
48.7 |
0.6 |
0.630 |
1 |
0 |
0 |
0.000 |
Average: |
49.7 |
0.6 |
0.635 |
1 |
0 |
0 |
0.000 |
23 |
33 |
|
A |
6 |
2 |
4549 |
◊ |
C |
-x+1/2,-y+1,z-1/2 |
2_564 |
4 |
1 |
5902 |
37.9 |
0.9 |
0.754 |
0 |
0 |
0 |
0.000 |
24 |
34 |
|
A |
5 |
1 |
4549 |
◊ |
F |
-x,y-1/2,-z+1/2 |
3_545 |
3 |
1 |
4508 |
37.8 |
-1.2 |
0.334 |
0 |
0 |
0 |
0.000 |
25 |
35 |
|
[ZN]D:138 |
1 |
1 |
98 |
c |
D |
x,y,z |
1_555 |
6 |
2 |
6806 |
35.2 |
-19.8 |
0.000 |
0 |
0 |
0 |
0.768 |
36 |
|
[ZN]D:138 |
1 |
1 |
98 |
◊ |
H |
x,y,z |
1_555 |
6 |
2 |
6510 |
34.7 |
-18.6 |
0.000 |
0 |
0 |
0 |
0.768 |
Average: |
34.9 |
-19.2 |
0.000 |
0 |
0 |
0 |
0.768 |
26 |
37 |
|
B |
2 |
1 |
4526 |
◊ |
C |
-x+1/2,-y+1,z-1/2 |
2_564 |
5 |
2 |
5902 |
31.2 |
-0.7 |
0.363 |
0 |
0 |
0 |
0.000 |
27 |
38 |
|
[ZN]C:137 |
1 |
1 |
98 |
f |
[ZN]C:136 |
x,y,z |
1_555 |
1 |
1 |
98 |
23.8 |
-19.0 |
0.000 |
0 |
0 |
0 |
0.100 |
28 |
39 |
|
[ZN]H:137 |
1 |
1 |
98 |
f |
[ZN]H:136 |
x,y,z |
1_555 |
1 |
1 |
98 |
23.5 |
-18.8 |
0.000 |
0 |
0 |
0 |
0.100 |
29 |
40 |
|
[ZN]D:137 |
1 |
1 |
98 |
f |
[ZN]D:136 |
x,y,z |
1_555 |
1 |
1 |
98 |
23.1 |
-18.5 |
0.000 |
0 |
0 |
0 |
0.100 |
30 |
41 |
|
[ZN]G:137 |
1 |
1 |
98 |
f |
[ZN]G:136 |
x,y,z |
1_555 |
1 |
1 |
98 |
23.0 |
-18.4 |
0.000 |
0 |
0 |
0 |
0.100 |
31 |
42 |
|
G |
2 |
1 |
5917 |
◊ |
B |
x-1/2,-y+3/2,-z |
4_465 |
3 |
1 |
4526 |
14.0 |
0.6 |
0.700 |
0 |
0 |
0 |
0.000 |
32 |
43 |
|
C |
3 |
1 |
5902 |
◊ |
E |
-x,y-1/2,-z+1/2 |
3_545 |
1 |
1 |
4563 |
13.2 |
-0.9 |
0.287 |
0 |
0 |
0 |
0.000 |
33 |
44 |
|
F |
3 |
1 |
4508 |
◊ |
C |
-x+1/2,-y+1,z-1/2 |
2_564 |
3 |
2 |
5902 |
12.4 |
-0.7 |
0.429 |
0 |
0 |
0 |
0.000 |
34 |
45 |
|
B |
1 |
1 |
4526 |
◊ |
G |
-x,y-1/2,-z+1/2 |
3_545 |
2 |
1 |
5917 |
12.2 |
-0.6 |
0.348 |
0 |
0 |
0 |
0.000 |
35 |
46 |
|
E |
3 |
1 |
4563 |
◊ |
H |
x-1/2,-y+3/2,-z |
4_465 |
2 |
1 |
6510 |
12.0 |
-0.1 |
0.470 |
0 |
0 |
0 |
0.000 |
36 |
47 |
|
G |
1 |
1 |
5917 |
x |
G |
x-1/2,-y+3/2,-z |
4_465 |
3 |
1 |
5917 |
5.2 |
0.2 |
0.784 |
0 |
0 |
0 |
0.000 |
37 |
48 |
|
D |
1 |
1 |
6806 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
3 |
1 |
4549 |
2.9 |
-0.1 |
0.487 |
0 |
0 |
0 |
0.000 |
38 |
49 |
|
E |
2 |
1 |
4563 |
◊ |
C |
-x+1/2,-y+1,z-1/2 |
2_564 |
1 |
1 |
5902 |
1.4 |
0.1 |
0.584 |
0 |
0 |
0 |
0.000 |
|