| ## |
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 |
|
[B12]D:0 |
77 |
1 |
1254 |
f |
D |
x,y,z |
1_555 |
135 |
43 |
20957 |
1004.7 |
-12.2 |
0.237 |
18 |
0 |
0 |
0.062 |
2 |
|
[B12]C:0 |
77 |
1 |
1248 |
f |
C |
x,y,z |
1_555 |
136 |
43 |
20882 |
1002.9 |
-12.3 |
0.249 |
19 |
0 |
0 |
0.062 |
3 |
|
[B12]A:0 |
76 |
1 |
1247 |
f |
A |
x,y,z |
1_555 |
137 |
43 |
20401 |
1001.8 |
-12.1 |
0.257 |
19 |
0 |
0 |
0.062 |
4 |
|
[B12]B:0 |
77 |
1 |
1247 |
f |
B |
x,y,z |
1_555 |
136 |
42 |
20333 |
1000.4 |
-12.2 |
0.254 |
19 |
0 |
0 |
0.062 |
| Average: |
1002.5 |
-12.2 |
0.249 |
19 |
0 |
0 |
0.062 |
| 2 |
5 |
|
B |
88 |
25 |
20333 |
x |
B |
-x+2,y-1/2,-z+1 |
2_746 |
103 |
26 |
20333 |
861.2 |
-0.7 |
0.620 |
12 |
1 |
0 |
0.000 |
6 |
|
A |
90 |
25 |
20401 |
x |
A |
-x+1,y-1/2,-z+1 |
2_646 |
105 |
26 |
20401 |
861.1 |
-1.5 |
0.530 |
12 |
0 |
0 |
0.000 |
7 |
|
C |
96 |
25 |
20882 |
x |
C |
-x+1,y-1/2,-z |
2_645 |
82 |
23 |
20882 |
789.3 |
-3.2 |
0.437 |
9 |
0 |
0 |
0.000 |
8 |
|
D |
97 |
24 |
20957 |
x |
D |
-x+2,y-1/2,-z |
2_745 |
82 |
23 |
20957 |
775.7 |
-2.8 |
0.462 |
9 |
0 |
0 |
0.000 |
| Average: |
821.8 |
-2.1 |
0.512 |
11 |
0 |
0 |
0.000 |
| 3 |
9 |
|
C |
70 |
21 |
20882 |
◊ |
D |
x-1,y,z |
1_455 |
63 |
20 |
20957 |
655.1 |
1.1 |
0.577 |
5 |
8 |
0 |
0.000 |
10 |
|
B |
70 |
23 |
20333 |
◊ |
A |
x,y,z |
1_555 |
69 |
19 |
20401 |
617.0 |
3.3 |
0.728 |
5 |
5 |
0 |
0.000 |
| Average: |
636.0 |
2.2 |
0.652 |
5 |
7 |
0 |
0.000 |
| 4 |
11 |
|
A |
53 |
15 |
20401 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
43 |
11 |
20882 |
417.7 |
-4.6 |
0.214 |
3 |
0 |
0 |
0.000 |
12 |
|
B |
44 |
13 |
20333 |
◊ |
D |
-x+2,y-1/2,-z+1 |
2_746 |
38 |
10 |
20957 |
371.3 |
-4.1 |
0.202 |
2 |
1 |
0 |
0.000 |
| Average: |
394.5 |
-4.3 |
0.208 |
3 |
1 |
0 |
0.000 |
| 5 |
13 |
|
D |
47 |
13 |
20957 |
◊ |
C |
x,y,z |
1_555 |
48 |
17 |
20882 |
388.8 |
-3.1 |
0.339 |
2 |
0 |
0 |
0.000 |
14 |
|
A |
46 |
13 |
20401 |
◊ |
B |
x-1,y,z |
1_455 |
48 |
18 |
20333 |
377.1 |
-0.9 |
0.547 |
2 |
0 |
0 |
0.000 |
| Average: |
383.0 |
-2.0 |
0.443 |
2 |
0 |
0 |
0.000 |
| 6 |
15 |
|
C |
45 |
16 |
20882 |
◊ |
D |
-x+1,y-1/2,-z |
2_645 |
31 |
9 |
20957 |
373.7 |
0.7 |
0.643 |
1 |
0 |
0 |
0.000 |
16 |
|
A |
37 |
8 |
20401 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
46 |
15 |
20333 |
344.9 |
2.0 |
0.791 |
2 |
0 |
0 |
0.000 |
| Average: |
359.3 |
1.3 |
0.717 |
2 |
0 |
0 |
0.000 |
| 7 |
17 |
|
C |
16 |
6 |
20882 |
◊ |
A |
x,y,z |
1_555 |
17 |
7 |
20401 |
155.6 |
-2.8 |
0.164 |
0 |
0 |
0 |
0.000 |
18 |
|
D |
15 |
5 |
20957 |
◊ |
B |
x,y,z |
1_555 |
16 |
6 |
20333 |
151.8 |
-2.7 |
0.162 |
0 |
0 |
0 |
0.000 |
| Average: |
153.7 |
-2.7 |
0.163 |
0 |
0 |
0 |
0.000 |
| 8 |
19 |
|
B |
18 |
7 |
20333 |
◊ |
C |
-x+1,y-1/2,-z |
2_645 |
15 |
5 |
20882 |
127.0 |
-0.1 |
0.428 |
0 |
0 |
0 |
0.000 |
| 9 |
20 |
|
B |
9 |
3 |
20333 |
◊ |
D |
-x+2,y-1/2,-z |
2_745 |
11 |
4 |
20957 |
90.9 |
-1.3 |
0.225 |
0 |
0 |
0 |
0.000 |
21 |
|
A |
10 |
4 |
20401 |
◊ |
C |
-x+1,y-1/2,-z |
2_645 |
11 |
5 |
20882 |
90.0 |
-1.4 |
0.240 |
0 |
0 |
0 |
0.000 |
| Average: |
90.5 |
-1.4 |
0.232 |
0 |
0 |
0 |
0.000 |
| 10 |
22 |
|
A |
16 |
5 |
20401 |
◊ |
D |
-x+1,y-1/2,-z |
2_645 |
11 |
4 |
20957 |
89.6 |
1.5 |
0.806 |
0 |
0 |
0 |
0.000 |
| 11 |
23 |
|
B |
6 |
2 |
20333 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
9 |
3 |
20882 |
77.5 |
-0.5 |
0.293 |
1 |
0 |
0 |
0.000 |
| 12 |
24 |
|
[CL]A:901 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
8 |
20401 |
59.6 |
-10.4 |
0.000 |
0 |
0 |
0 |
0.032 |
25 |
|
[CL]D:903 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
12 |
8 |
20957 |
58.7 |
-10.3 |
0.000 |
0 |
0 |
0 |
0.032 |
26 |
|
[CL]C:904 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
10 |
5 |
20882 |
58.7 |
-10.4 |
0.000 |
0 |
0 |
0 |
0.032 |
27 |
|
[CL]B:902 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
11 |
7 |
20333 |
58.2 |
-10.3 |
0.000 |
0 |
0 |
0 |
0.032 |
| Average: |
58.8 |
-10.3 |
0.000 |
0 |
0 |
0 |
0.032 |
| 13 |
28 |
|
A |
4 |
2 |
20401 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
9 |
3 |
20957 |
48.1 |
0.0 |
0.547 |
0 |
0 |
0 |
0.000 |
| 14 |
29 |
|
[B12]D:0 |
2 |
1 |
1254 |
f |
[CL]D:903 |
x,y,z |
1_555 |
1 |
1 |
125 |
26.0 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.007 |
30 |
|
[B12]B:0 |
3 |
1 |
1247 |
f |
[CL]B:902 |
x,y,z |
1_555 |
1 |
1 |
125 |
25.9 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.007 |
31 |
|
[B12]A:0 |
2 |
1 |
1247 |
f |
[CL]A:901 |
x,y,z |
1_555 |
1 |
1 |
125 |
25.5 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.007 |
32 |
|
[B12]C:0 |
3 |
1 |
1248 |
f |
[CL]C:904 |
x,y,z |
1_555 |
1 |
1 |
125 |
24.9 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.007 |
| Average: |
25.6 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.007 |
| 15 |
33 |
|
C |
2 |
1 |
20882 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
20333 |
16.3 |
-0.1 |
0.510 |
0 |
0 |
0 |
0.000 |
| 16 |
34 |
|
A |
3 |
1 |
20401 |
◊ |
B |
-x+2,y-1/2,-z+1 |
2_746 |
1 |
1 |
20333 |
6.0 |
-0.0 |
0.443 |
0 |
0 |
0 |
0.000 |
35 |
|
C |
1 |
1 |
20882 |
◊ |
D |
-x+2,y-1/2,-z |
2_745 |
2 |
1 |
20957 |
2.3 |
-0.0 |
0.523 |
0 |
0 |
0 |
0.000 |
| Average: |
4.1 |
-0.0 |
0.483 |
0 |
0 |
0 |
0.000 |
|