| ## |
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 |
406 |
95 |
16140 |
◊ |
A |
x,y,z |
1_555 |
403 |
97 |
16193 |
4086.2 |
-72.3 |
0.001 |
26 |
19 |
0 |
0.703 |
2 |
|
D |
390 |
93 |
16294 |
◊ |
B |
x,y,z |
1_555 |
393 |
93 |
15828 |
4061.3 |
-69.5 |
0.002 |
29 |
17 |
0 |
0.703 |
| Average: |
4073.7 |
-70.9 |
0.001 |
28 |
18 |
0 |
0.703 |
| 2 |
3 |
|
[NAD]A:312 |
43 |
1 |
837 |
f |
A |
x,y,z |
1_555 |
86 |
33 |
16193 |
598.2 |
-9.8 |
0.399 |
10 |
0 |
0 |
0.234 |
4 |
|
[NAD]C:312 |
43 |
1 |
828 |
f |
C |
x,y,z |
1_555 |
87 |
34 |
16140 |
597.1 |
-9.7 |
0.452 |
11 |
0 |
0 |
0.234 |
5 |
|
[NAD]B:312 |
43 |
1 |
835 |
f |
B |
x,y,z |
1_555 |
84 |
35 |
15828 |
595.2 |
-9.6 |
0.417 |
10 |
0 |
0 |
0.234 |
6 |
|
[NAD]D:312 |
44 |
1 |
838 |
f |
D |
x,y,z |
1_555 |
82 |
33 |
16294 |
585.8 |
-8.9 |
0.438 |
11 |
0 |
0 |
0.234 |
| Average: |
594.1 |
-9.5 |
0.427 |
11 |
0 |
0 |
0.234 |
| 3 |
7 |
|
A |
33 |
12 |
16193 |
x |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
34 |
7 |
16193 |
299.1 |
-3.2 |
0.439 |
0 |
0 |
0 |
0.000 |
| 4 |
8 |
|
D |
26 |
9 |
16294 |
◊ |
A |
-x+1/2,-y-1,z-1/2 |
2_544 |
27 |
7 |
16193 |
271.5 |
1.6 |
0.829 |
4 |
2 |
0 |
0.000 |
| 5 |
9 |
|
D |
26 |
9 |
16294 |
x |
D |
x-1/2,-y-1/2,-z |
4_445 |
29 |
7 |
16294 |
240.3 |
-0.8 |
0.657 |
1 |
2 |
0 |
0.000 |
| 6 |
10 |
|
C |
22 |
8 |
16140 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
26 |
8 |
15828 |
219.7 |
2.8 |
0.903 |
5 |
4 |
0 |
0.000 |
| 7 |
11 |
|
[HPP]C:313 |
12 |
1 |
336 |
f |
C |
x,y,z |
1_555 |
36 |
17 |
16140 |
183.5 |
4.8 |
0.442 |
5 |
0 |
0 |
0.000 |
| 8 |
12 |
|
[HPP]B:313 |
12 |
1 |
334 |
f |
B |
x,y,z |
1_555 |
34 |
16 |
15828 |
182.5 |
3.1 |
0.342 |
5 |
0 |
0 |
0.000 |
| 9 |
13 |
|
D |
32 |
11 |
16294 |
◊ |
C |
-x+1/2,-y-1,z-1/2 |
2_544 |
18 |
5 |
16140 |
179.1 |
-0.5 |
0.563 |
0 |
0 |
0 |
0.000 |
| 10 |
14 |
|
C |
19 |
5 |
16140 |
◊ |
B |
x,y-1,z |
1_545 |
20 |
5 |
15828 |
167.1 |
-0.9 |
0.578 |
2 |
0 |
0 |
0.000 |
| 11 |
15 |
|
C |
15 |
6 |
16140 |
◊ |
D |
x-1/2,-y-1/2,-z |
4_445 |
18 |
5 |
16294 |
158.5 |
-3.4 |
0.234 |
0 |
0 |
0 |
0.000 |
16 |
|
A |
16 |
5 |
16193 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
14 |
5 |
15828 |
134.2 |
-2.1 |
0.363 |
1 |
0 |
0 |
0.000 |
| Average: |
146.3 |
-2.8 |
0.299 |
1 |
0 |
0 |
0.000 |
| 12 |
17 |
|
D |
13 |
5 |
16294 |
◊ |
B |
x,y-1,z |
1_545 |
12 |
6 |
15828 |
110.4 |
0.7 |
0.720 |
1 |
1 |
0 |
0.000 |
18 |
|
A |
10 |
4 |
16193 |
◊ |
C |
x,y-1,z |
1_545 |
11 |
5 |
16140 |
98.8 |
0.4 |
0.727 |
0 |
1 |
0 |
0.000 |
| Average: |
104.6 |
0.6 |
0.724 |
1 |
1 |
0 |
0.000 |
| 13 |
19 |
|
D |
11 |
4 |
16294 |
◊ |
A |
x-1/2,-y-3/2,-z |
4_435 |
12 |
4 |
16193 |
109.4 |
0.6 |
0.761 |
0 |
0 |
0 |
0.000 |
| 14 |
20 |
|
C |
11 |
3 |
16140 |
◊ |
B |
x,y,z |
1_555 |
13 |
3 |
15828 |
103.9 |
-0.5 |
0.621 |
2 |
1 |
0 |
0.000 |
| 15 |
21 |
|
B |
13 |
5 |
15828 |
◊ |
A |
-x+1/2,-y-1,z-1/2 |
2_544 |
12 |
6 |
16193 |
94.4 |
1.5 |
0.815 |
1 |
0 |
0 |
0.000 |
| 16 |
22 |
|
D |
9 |
2 |
16294 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
11 |
2 |
15828 |
94.4 |
-0.6 |
0.564 |
1 |
2 |
0 |
0.000 |
| 17 |
23 |
|
D |
8 |
3 |
16294 |
◊ |
C |
x,y,z |
1_555 |
9 |
4 |
16140 |
90.3 |
1.6 |
0.806 |
0 |
1 |
0 |
0.000 |
| 18 |
24 |
|
B |
10 |
3 |
15828 |
x |
B |
x-1/2,-y-1/2,-z |
4_445 |
8 |
2 |
15828 |
75.4 |
-1.4 |
0.390 |
0 |
0 |
0 |
0.000 |
| 19 |
25 |
|
A |
9 |
2 |
16193 |
◊ |
C |
-x+1,y-1/2,-z+1/2 |
3_645 |
7 |
2 |
16140 |
68.1 |
0.4 |
0.746 |
0 |
0 |
0 |
0.000 |
| 20 |
26 |
|
[HPP]C:313 |
10 |
1 |
336 |
◊ |
A |
x,y,z |
1_555 |
8 |
4 |
16193 |
63.2 |
1.5 |
0.141 |
0 |
0 |
0 |
0.000 |
| 21 |
27 |
|
[HPP]B:313 |
9 |
1 |
334 |
f |
[NAD]B:312 |
x,y,z |
1_555 |
9 |
1 |
835 |
63.1 |
0.5 |
0.118 |
0 |
0 |
0 |
0.000 |
| 22 |
28 |
|
[HPP]B:313 |
10 |
1 |
334 |
◊ |
D |
x,y,z |
1_555 |
10 |
5 |
16294 |
62.4 |
1.6 |
0.146 |
0 |
0 |
0 |
0.000 |
| 23 |
29 |
|
[HPP]C:313 |
8 |
1 |
336 |
f |
[NAD]C:312 |
x,y,z |
1_555 |
8 |
1 |
828 |
61.2 |
0.6 |
0.155 |
0 |
0 |
0 |
0.000 |
| 24 |
30 |
|
D |
5 |
2 |
16294 |
◊ |
A |
x,y,z |
1_555 |
10 |
5 |
16193 |
59.0 |
1.8 |
0.876 |
1 |
0 |
0 |
0.000 |
| 25 |
31 |
|
D |
8 |
3 |
16294 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
5 |
2 |
15828 |
52.9 |
0.1 |
0.452 |
0 |
0 |
0 |
0.000 |
| 26 |
32 |
|
[CL]B:314 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
9 |
4 |
16294 |
51.1 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.055 |
33 |
|
[CL]A:313 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
16193 |
50.2 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.055 |
| Average: |
50.6 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.055 |
| 27 |
34 |
|
[CL]B:314 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
10 |
3 |
15828 |
51.0 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.048 |
35 |
|
[CL]A:313 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
11 |
3 |
16140 |
50.5 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.048 |
| Average: |
50.7 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.048 |
| 28 |
36 |
|
D |
6 |
3 |
16294 |
◊ |
C |
x-1/2,-y-1/2,-z |
4_445 |
3 |
1 |
16140 |
50.0 |
-0.1 |
0.506 |
0 |
0 |
0 |
0.000 |
| 29 |
37 |
|
[NAD]A:312 |
2 |
1 |
837 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
5 |
2 |
16193 |
37.0 |
0.7 |
0.788 |
1 |
0 |
0 |
0.000 |
| 30 |
38 |
|
A |
3 |
2 |
16193 |
◊ |
B |
x,y-1,z |
1_545 |
5 |
2 |
15828 |
31.3 |
1.1 |
0.854 |
0 |
0 |
0 |
0.000 |
| 31 |
39 |
|
B |
3 |
2 |
15828 |
◊ |
C |
x-1/2,-y-1/2,-z |
4_445 |
6 |
3 |
16140 |
23.8 |
0.3 |
0.743 |
0 |
0 |
0 |
0.000 |
| 32 |
40 |
|
B |
4 |
2 |
15828 |
◊ |
C |
-x+1/2,-y,z-1/2 |
2_554 |
3 |
2 |
16140 |
18.5 |
0.1 |
0.714 |
0 |
0 |
0 |
0.000 |
| 33 |
41 |
|
B |
2 |
1 |
15828 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
2 |
1 |
16193 |
11.7 |
0.2 |
0.575 |
0 |
0 |
0 |
0.000 |
| 34 |
42 |
|
A |
3 |
2 |
16193 |
◊ |
D |
x,y-1,z |
1_545 |
2 |
2 |
16294 |
3.4 |
0.1 |
0.704 |
0 |
0 |
0 |
0.000 |
| 35 |
43 |
|
A |
1 |
1 |
16193 |
◊ |
C |
-x,y-1/2,-z+1/2 |
3_545 |
1 |
1 |
16140 |
0.8 |
0.0 |
0.747 |
0 |
0 |
0 |
0.000 |
|