| ## |
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 |
173 |
49 |
12383 |
◊ |
C |
x,y,z |
1_555 |
173 |
50 |
12580 |
1651.0 |
-30.0 |
0.077 |
12 |
6 |
0 |
0.319 |
2 |
|
B |
159 |
45 |
12051 |
◊ |
A |
x,y,z |
1_555 |
160 |
45 |
11542 |
1563.3 |
-28.3 |
0.078 |
12 |
8 |
0 |
0.319 |
| Average: |
1607.2 |
-29.2 |
0.078 |
12 |
7 |
0 |
0.319 |
| 2 |
3 |
|
[NAP]C:1272 |
47 |
1 |
882 |
f |
C |
x,y,z |
1_555 |
85 |
33 |
12580 |
610.0 |
-4.6 |
0.640 |
21 |
0 |
0 |
0.238 |
4 |
|
[NAP]B:1278 |
47 |
1 |
882 |
f |
B |
x,y,z |
1_555 |
87 |
32 |
12051 |
607.2 |
-4.7 |
0.657 |
20 |
0 |
0 |
0.238 |
5 |
|
[NAP]D:1278 |
47 |
1 |
886 |
f |
D |
x,y,z |
1_555 |
92 |
32 |
12383 |
605.9 |
-4.3 |
0.634 |
20 |
0 |
0 |
0.238 |
6 |
|
[NAP]A:1269 |
47 |
1 |
881 |
f |
A |
x,y,z |
1_555 |
88 |
33 |
11542 |
604.1 |
-4.3 |
0.656 |
20 |
0 |
0 |
0.238 |
| Average: |
606.8 |
-4.5 |
0.647 |
20 |
0 |
0 |
0.238 |
| 3 |
7 |
|
[CBO]A:1270 |
34 |
1 |
731 |
f |
A |
x,y,z |
1_555 |
65 |
26 |
11542 |
494.4 |
-8.0 |
0.406 |
6 |
0 |
0 |
0.167 |
8 |
|
[CBO]D:1279 |
30 |
1 |
687 |
f |
D |
x,y,z |
1_555 |
66 |
24 |
12383 |
466.9 |
-6.8 |
0.383 |
3 |
0 |
0 |
0.167 |
9 |
|
[CBO]B:1279 |
30 |
1 |
686 |
f |
B |
x,y,z |
1_555 |
65 |
27 |
12051 |
465.2 |
-6.7 |
0.452 |
4 |
0 |
0 |
0.167 |
10 |
|
[CBO]C:1273 |
30 |
1 |
693 |
f |
C |
x,y,z |
1_555 |
58 |
22 |
12580 |
446.7 |
-6.2 |
0.432 |
5 |
0 |
0 |
0.167 |
| Average: |
468.3 |
-6.9 |
0.418 |
5 |
0 |
0 |
0.167 |
| 4 |
11 |
|
C |
52 |
14 |
12580 |
◊ |
D |
-x+1/2,y-1/2,-z |
3_545 |
52 |
16 |
12383 |
456.0 |
-1.8 |
0.768 |
6 |
0 |
0 |
0.000 |
| 5 |
12 |
|
C |
46 |
10 |
12580 |
◊ |
A |
-x+1/2,y-1/2,-z |
3_545 |
41 |
13 |
11542 |
445.4 |
-8.3 |
0.105 |
2 |
0 |
0 |
0.038 |
| 6 |
13 |
|
B |
32 |
9 |
12051 |
◊ |
A |
x,y,z-1 |
1_554 |
39 |
12 |
11542 |
336.4 |
-0.1 |
0.828 |
3 |
4 |
0 |
0.000 |
| 7 |
14 |
|
D |
18 |
6 |
12383 |
◊ |
B |
x,y,z |
1_555 |
18 |
6 |
12051 |
172.0 |
-0.8 |
0.652 |
1 |
0 |
0 |
0.000 |
| 8 |
15 |
|
B |
15 |
4 |
12051 |
◊ |
D |
x-1/2,-y+1/2,-z |
4_455 |
16 |
3 |
12383 |
141.7 |
-1.2 |
0.573 |
1 |
0 |
0 |
0.000 |
| 9 |
16 |
|
C |
14 |
4 |
12580 |
◊ |
B |
-x+1/2,y-1/2,-z |
3_545 |
13 |
5 |
12051 |
126.7 |
-2.3 |
0.306 |
1 |
0 |
0 |
0.012 |
| 10 |
17 |
|
[CBO]C:1273 |
11 |
1 |
693 |
f |
[NAP]C:1272 |
x,y,z |
1_555 |
16 |
1 |
882 |
109.5 |
-3.9 |
0.369 |
0 |
0 |
0 |
0.069 |
18 |
|
[CBO]D:1279 |
11 |
1 |
687 |
f |
[NAP]D:1278 |
x,y,z |
1_555 |
16 |
1 |
886 |
107.9 |
-4.0 |
0.351 |
0 |
0 |
0 |
0.069 |
19 |
|
[CBO]B:1279 |
11 |
1 |
686 |
f |
[NAP]B:1278 |
x,y,z |
1_555 |
16 |
1 |
882 |
107.7 |
-4.0 |
0.365 |
0 |
0 |
0 |
0.069 |
20 |
|
[CBO]A:1270 |
11 |
1 |
731 |
f |
[NAP]A:1269 |
x,y,z |
1_555 |
16 |
1 |
881 |
104.6 |
-3.9 |
0.383 |
0 |
0 |
0 |
0.069 |
| Average: |
107.4 |
-4.0 |
0.367 |
0 |
0 |
0 |
0.069 |
| 11 |
21 |
|
A |
7 |
2 |
11542 |
◊ |
D |
x-1/2,-y+1/2,-z |
4_455 |
14 |
5 |
12383 |
91.9 |
-1.8 |
0.337 |
0 |
0 |
0 |
0.000 |
| 12 |
22 |
|
D |
6 |
3 |
12383 |
◊ |
A |
x,y,z |
1_555 |
9 |
3 |
11542 |
81.5 |
-0.3 |
0.607 |
0 |
0 |
0 |
0.000 |
| 13 |
23 |
|
[CL]D:1280 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
12 |
7 |
12383 |
76.0 |
-11.2 |
0.000 |
0 |
0 |
0 |
0.197 |
24 |
|
[CL]B:1280 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
12051 |
75.2 |
-11.3 |
0.000 |
0 |
0 |
0 |
0.197 |
25 |
|
[CL]A:1271 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
7 |
11542 |
74.6 |
-11.0 |
0.000 |
0 |
0 |
0 |
0.197 |
26 |
|
[CL]C:1274 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
12 |
7 |
12580 |
74.6 |
-11.2 |
0.000 |
0 |
0 |
0 |
0.197 |
| Average: |
75.1 |
-11.2 |
0.000 |
0 |
0 |
0 |
0.197 |
| 14 |
27 |
|
C |
8 |
3 |
12580 |
◊ |
[CBO]A:1270 |
-x+1/2,y-1/2,-z |
3_545 |
8 |
1 |
731 |
59.2 |
-0.6 |
0.497 |
0 |
0 |
0 |
0.003 |
| 15 |
28 |
|
D |
3 |
2 |
12383 |
◊ |
A |
-x,-y,z |
2_555 |
2 |
1 |
11542 |
31.8 |
1.2 |
0.812 |
1 |
0 |
0 |
0.000 |
| 16 |
29 |
|
C |
3 |
1 |
12580 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
12051 |
25.1 |
0.1 |
0.554 |
0 |
0 |
0 |
0.000 |
| 17 |
30 |
|
C |
6 |
5 |
12580 |
◊ |
D |
x,y,z-1 |
1_554 |
5 |
4 |
12383 |
20.9 |
-0.4 |
0.577 |
0 |
0 |
0 |
0.000 |
| 18 |
31 |
|
[CL]D:1280 |
1 |
1 |
125 |
f |
[NAP]D:1278 |
x,y,z |
1_555 |
1 |
1 |
886 |
11.5 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.031 |
32 |
|
[CL]B:1280 |
1 |
1 |
125 |
f |
[NAP]B:1278 |
x,y,z |
1_555 |
1 |
1 |
882 |
11.5 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.031 |
33 |
|
[CL]C:1274 |
1 |
1 |
125 |
f |
[NAP]C:1272 |
x,y,z |
1_555 |
1 |
1 |
882 |
11.4 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.031 |
34 |
|
[CL]A:1271 |
1 |
1 |
125 |
f |
[NAP]A:1269 |
x,y,z |
1_555 |
1 |
1 |
881 |
11.0 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.031 |
| Average: |
11.4 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.031 |
| 19 |
35 |
|
C |
1 |
1 |
12580 |
◊ |
B |
-x+1/2,y-1/2,-z-1 |
3_544 |
1 |
1 |
12051 |
11.5 |
0.4 |
0.891 |
0 |
0 |
0 |
0.000 |
| 20 |
36 |
|
[NAP]D:1278 |
2 |
1 |
886 |
◊ |
A |
-x,-y,z |
2_555 |
2 |
1 |
11542 |
8.6 |
0.3 |
0.682 |
0 |
0 |
0 |
0.000 |
| 21 |
37 |
|
C |
1 |
1 |
12580 |
◊ |
A |
-x,-y,z-1 |
2_554 |
1 |
1 |
11542 |
0.4 |
-0.0 |
0.639 |
0 |
0 |
0 |
0.000 |
|