## |
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 |
288 |
69 |
12958 |
◊ |
C |
x,y,z |
1_555 |
323 |
83 |
12787 |
2967.4 |
-38.7 |
0.154 |
38 |
14 |
0 |
0.846 |
2 |
|
B |
266 |
62 |
12337 |
◊ |
A |
x,y,z |
1_555 |
297 |
75 |
11866 |
2699.5 |
-34.8 |
0.160 |
36 |
13 |
0 |
0.846 |
Average: |
2833.4 |
-36.7 |
0.157 |
37 |
14 |
0 |
0.846 |
2 |
3 |
|
B |
76 |
20 |
12337 |
◊ |
C |
-x+1,y-1/2,-z+1/2 |
3_645 |
81 |
21 |
12787 |
744.1 |
-4.5 |
0.655 |
15 |
2 |
0 |
0.566 |
4 |
|
A |
78 |
21 |
11866 |
◊ |
D |
-x+1,y-1/2,-z+1/2 |
3_645 |
74 |
19 |
12958 |
733.2 |
-4.9 |
0.655 |
15 |
2 |
0 |
0.566 |
Average: |
738.6 |
-4.7 |
0.655 |
15 |
2 |
0 |
0.566 |
3 |
5 |
|
A |
70 |
20 |
11866 |
◊ |
C |
x-1/2,-y+3/2,-z+1 |
4_466 |
73 |
20 |
12787 |
669.9 |
-7.2 |
0.554 |
4 |
0 |
0 |
0.000 |
4 |
6 |
|
A |
68 |
22 |
11866 |
◊ |
C |
-x+1,y-1/2,-z+1/2 |
3_645 |
66 |
20 |
12787 |
657.0 |
-5.4 |
0.657 |
2 |
0 |
0 |
0.037 |
5 |
7 |
|
B |
25 |
9 |
12337 |
x |
B |
-x,y-1/2,-z+1/2 |
3_545 |
27 |
7 |
12337 |
224.3 |
-2.5 |
0.437 |
0 |
0 |
0 |
0.000 |
6 |
8 |
|
A |
21 |
6 |
11866 |
◊ |
C |
x,y-1,z |
1_545 |
18 |
4 |
12787 |
197.3 |
-2.4 |
0.398 |
1 |
1 |
0 |
0.000 |
7 |
9 |
|
B |
16 |
5 |
12337 |
◊ |
C |
x,y-1,z |
1_545 |
14 |
4 |
12787 |
152.2 |
-2.3 |
0.233 |
0 |
0 |
0 |
0.000 |
8 |
10 |
|
D |
9 |
4 |
12958 |
x |
D |
-x+1,y-1/2,-z+1/2 |
3_645 |
15 |
3 |
12958 |
118.3 |
-1.4 |
0.448 |
1 |
0 |
0 |
0.000 |
9 |
11 |
|
[NDG]C:213 |
9 |
1 |
360 |
◊ |
D |
-x+1,y-1/2,-z+1/2 |
3_645 |
17 |
6 |
12958 |
113.7 |
2.2 |
0.393 |
1 |
0 |
0 |
0.000 |
10 |
12 |
|
A |
9 |
3 |
11866 |
◊ |
D |
x,y-1,z |
1_545 |
5 |
3 |
12958 |
91.6 |
-2.5 |
0.071 |
0 |
0 |
0 |
0.000 |
11 |
13 |
|
[NDG]A:213 |
10 |
1 |
359 |
◊ |
D |
-x+1,y-1/2,-z+1/2 |
3_645 |
12 |
5 |
12958 |
89.3 |
1.0 |
0.128 |
1 |
0 |
0 |
0.000 |
14 |
|
B |
16 |
5 |
12337 |
◊ |
[NDG]C:213 |
-x+1,y-1/2,-z+1/2 |
3_645 |
11 |
1 |
360 |
82.7 |
0.9 |
0.109 |
2 |
0 |
0 |
0.000 |
Average: |
86.0 |
0.9 |
0.118 |
2 |
0 |
0 |
0.000 |
12 |
15 |
|
[NDG]C:212 |
7 |
1 |
359 |
cf |
C |
x,y,z |
1_555 |
12 |
4 |
12787 |
87.7 |
3.1 |
0.650 |
0 |
0 |
0 |
0.000 |
16 |
|
[NDG]A:212 |
7 |
1 |
361 |
cf |
A |
x,y,z |
1_555 |
9 |
3 |
11866 |
83.1 |
2.9 |
0.518 |
0 |
0 |
0 |
0.000 |
Average: |
85.4 |
3.0 |
0.584 |
0 |
0 |
0 |
0.000 |
13 |
17 |
|
B |
11 |
4 |
12337 |
◊ |
D |
x,y-1,z |
1_545 |
6 |
2 |
12958 |
87.4 |
-2.3 |
0.058 |
0 |
0 |
0 |
0.000 |
14 |
18 |
|
[NDG]A:212 |
9 |
1 |
361 |
◊ |
D |
-x+1,y-1/2,-z+1/2 |
3_645 |
7 |
3 |
12958 |
77.3 |
0.1 |
0.089 |
0 |
0 |
0 |
0.000 |
19 |
|
B |
7 |
3 |
12337 |
◊ |
[NDG]C:212 |
-x+1,y-1/2,-z+1/2 |
3_645 |
9 |
1 |
359 |
68.3 |
0.1 |
0.083 |
0 |
0 |
0 |
0.000 |
Average: |
72.8 |
0.1 |
0.086 |
0 |
0 |
0 |
0.000 |
15 |
20 |
|
[NDG]A:212 |
8 |
1 |
361 |
◊ |
B |
x,y,z |
1_555 |
10 |
3 |
12337 |
77.0 |
1.3 |
0.237 |
0 |
0 |
0 |
0.000 |
21 |
|
[NDG]C:212 |
8 |
1 |
359 |
◊ |
D |
x,y,z |
1_555 |
9 |
3 |
12958 |
67.3 |
0.9 |
0.240 |
0 |
0 |
0 |
0.000 |
Average: |
72.1 |
1.1 |
0.239 |
0 |
0 |
0 |
0.000 |
16 |
22 |
|
[NDG]A:213 |
8 |
1 |
359 |
cf |
[NDG]A:212 |
x,y,z |
1_555 |
7 |
1 |
361 |
75.2 |
1.8 |
0.053 |
1 |
0 |
0 |
0.000 |
23 |
|
[NDG]C:213 |
8 |
1 |
360 |
cf |
[NDG]C:212 |
x,y,z |
1_555 |
7 |
1 |
359 |
62.8 |
1.5 |
0.053 |
1 |
0 |
0 |
0.000 |
Average: |
69.0 |
1.7 |
0.053 |
1 |
0 |
0 |
0.000 |
17 |
24 |
|
[NDG]C:212 |
10 |
1 |
359 |
◊ |
D |
-x+1,y-1/2,-z+1/2 |
3_645 |
11 |
4 |
12958 |
73.6 |
0.2 |
0.110 |
0 |
0 |
0 |
0.000 |
18 |
25 |
|
[BMA]C:215 |
7 |
1 |
290 |
◊ |
D |
-x+1,y-1/2,-z+1/2 |
3_645 |
9 |
5 |
12958 |
73.0 |
1.0 |
0.303 |
0 |
0 |
0 |
0.000 |
19 |
26 |
|
B |
13 |
5 |
12337 |
◊ |
[BMA]C:214 |
-x+1,y-1/2,-z+1/2 |
3_645 |
8 |
1 |
290 |
68.8 |
0.8 |
0.240 |
4 |
0 |
0 |
0.054 |
27 |
|
[BMA]A:214 |
7 |
1 |
289 |
◊ |
D |
-x+1,y-1/2,-z+1/2 |
3_645 |
10 |
5 |
12958 |
62.8 |
0.6 |
0.281 |
4 |
0 |
0 |
0.054 |
Average: |
65.8 |
0.7 |
0.261 |
4 |
0 |
0 |
0.054 |
20 |
28 |
|
[BMA]A:214 |
6 |
1 |
289 |
cf |
[NDG]A:213 |
x,y,z |
1_555 |
6 |
1 |
359 |
59.0 |
1.0 |
0.068 |
0 |
0 |
0 |
0.000 |
29 |
|
[BMA]C:214 |
6 |
1 |
290 |
cf |
[NDG]C:213 |
x,y,z |
1_555 |
6 |
1 |
360 |
55.1 |
1.1 |
0.068 |
0 |
0 |
0 |
0.000 |
Average: |
57.0 |
1.0 |
0.068 |
0 |
0 |
0 |
0.000 |
21 |
30 |
|
[CL]A:503 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
12337 |
57.4 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.330 |
31 |
|
[CL]C:504 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
12 |
6 |
12958 |
56.0 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.330 |
Average: |
56.7 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.330 |
22 |
32 |
|
[CL]C:504 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
12 |
5 |
12787 |
55.2 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.099 |
33 |
|
[CL]A:503 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
13 |
6 |
11866 |
50.6 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.099 |
Average: |
52.9 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.099 |
23 |
34 |
|
[CL]B:501 |
1 |
1 |
125 |
f |
C |
-x+1,y-1/2,-z+1/2 |
3_645 |
7 |
4 |
12787 |
53.9 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.285 |
35 |
|
A |
5 |
3 |
11866 |
f |
[CL]D:502 |
-x+1,y-1/2,-z+1/2 |
3_645 |
1 |
1 |
125 |
53.5 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.285 |
Average: |
53.7 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.285 |
24 |
36 |
|
[BMA]C:215 |
5 |
1 |
290 |
cf |
[BMA]C:214 |
x,y,z |
1_555 |
4 |
1 |
290 |
52.9 |
2.2 |
0.326 |
0 |
0 |
0 |
0.000 |
37 |
|
[BMA]A:215 |
5 |
1 |
290 |
cf |
[BMA]A:214 |
x,y,z |
1_555 |
4 |
1 |
289 |
52.3 |
2.2 |
0.326 |
0 |
0 |
0 |
0.000 |
Average: |
52.6 |
2.2 |
0.326 |
0 |
0 |
0 |
0.000 |
25 |
38 |
|
[BMA]C:215 |
4 |
1 |
290 |
◊ |
C |
-x+1,y-1/2,-z+1/2 |
3_645 |
6 |
2 |
12787 |
48.7 |
0.3 |
0.290 |
0 |
0 |
0 |
0.000 |
26 |
39 |
|
C |
5 |
1 |
12787 |
◊ |
D |
-x+1,y-1/2,-z+1/2 |
3_645 |
8 |
2 |
12958 |
45.5 |
0.0 |
0.655 |
0 |
0 |
0 |
0.000 |
27 |
40 |
|
[BMA]A:215 |
3 |
1 |
290 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
5 |
1 |
11866 |
44.7 |
0.0 |
0.366 |
0 |
0 |
0 |
0.000 |
28 |
41 |
|
[BMA]C:214 |
5 |
1 |
290 |
◊ |
D |
-x+1,y-1/2,-z+1/2 |
3_645 |
5 |
3 |
12958 |
43.5 |
0.9 |
0.328 |
0 |
0 |
0 |
0.000 |
29 |
42 |
|
[NDG]A:213 |
6 |
1 |
359 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
3 |
2 |
12337 |
40.8 |
0.9 |
0.196 |
0 |
0 |
0 |
0.000 |
30 |
43 |
|
[BMA]A:215 |
4 |
1 |
290 |
◊ |
D |
-x+1,y-1/2,-z+1/2 |
3_645 |
4 |
2 |
12958 |
35.8 |
0.5 |
0.306 |
0 |
0 |
0 |
0.000 |
44 |
|
B |
3 |
2 |
12337 |
◊ |
[BMA]C:215 |
-x+1,y-1/2,-z+1/2 |
3_645 |
4 |
1 |
290 |
34.9 |
0.8 |
0.284 |
0 |
0 |
0 |
0.000 |
Average: |
35.4 |
0.7 |
0.295 |
0 |
0 |
0 |
0.000 |
31 |
45 |
|
[CL]B:501 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
12337 |
35.5 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.207 |
46 |
|
[CL]D:502 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
7 |
2 |
12958 |
32.6 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.207 |
Average: |
34.0 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.207 |
32 |
47 |
|
[NDG]A:213 |
3 |
1 |
359 |
◊ |
B |
x,y,z |
1_555 |
7 |
2 |
12337 |
31.8 |
1.2 |
0.590 |
0 |
0 |
0 |
0.000 |
48 |
|
[NDG]C:213 |
3 |
1 |
360 |
◊ |
D |
x,y,z |
1_555 |
6 |
2 |
12958 |
31.0 |
1.1 |
0.601 |
0 |
0 |
0 |
0.000 |
Average: |
31.4 |
1.1 |
0.595 |
0 |
0 |
0 |
0.000 |
33 |
49 |
|
[CL]B:501 |
1 |
1 |
125 |
◊ |
D |
-x+1,y-1/2,-z+1/2 |
3_645 |
1 |
1 |
12958 |
9.1 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.012 |
50 |
|
B |
1 |
1 |
12337 |
◊ |
[CL]D:502 |
-x+1,y-1/2,-z+1/2 |
3_645 |
1 |
1 |
125 |
5.9 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.012 |
Average: |
7.5 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.012 |
34 |
51 |
|
[BMA]A:215 |
1 |
1 |
290 |
f |
[NDG]A:213 |
x,y,z |
1_555 |
1 |
1 |
359 |
7.8 |
0.1 |
0.140 |
0 |
0 |
0 |
0.000 |
52 |
|
[BMA]C:215 |
1 |
1 |
290 |
f |
[NDG]C:213 |
x,y,z |
1_555 |
1 |
1 |
360 |
6.8 |
0.1 |
0.140 |
0 |
0 |
0 |
0.000 |
Average: |
7.3 |
0.1 |
0.140 |
0 |
0 |
0 |
0.000 |
35 |
53 |
|
[BMA]A:215 |
2 |
1 |
290 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
2 |
1 |
12337 |
6.7 |
0.2 |
0.433 |
0 |
0 |
0 |
0.000 |
36 |
54 |
|
[NDG]A:213 |
2 |
1 |
359 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
3 |
1 |
11866 |
6.3 |
-0.0 |
0.245 |
0 |
0 |
0 |
0.000 |
37 |
55 |
|
[NDG]A:212 |
1 |
1 |
361 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
1 |
1 |
12337 |
5.5 |
-0.2 |
0.160 |
0 |
0 |
0 |
0.000 |
38 |
56 |
|
B |
1 |
1 |
12337 |
◊ |
D |
-x+1,y-1/2,-z+1/2 |
3_645 |
1 |
1 |
12958 |
0.2 |
-0.0 |
0.646 |
0 |
0 |
0 |
0.000 |
|