## |
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 |
|
B |
134 |
35 |
11003 |
◊ |
A |
x,y,z |
1_555 |
132 |
35 |
11389 |
1255.7 |
-11.6 |
0.228 |
12 |
16 |
0 |
0.173 |
2 |
2 |
|
A |
64 |
22 |
11389 |
x |
A |
x-1/2,-y-1/2,-z |
4_445 |
64 |
22 |
11389 |
552.2 |
-2.9 |
0.370 |
2 |
1 |
0 |
0.000 |
3 |
3 |
|
B |
34 |
11 |
11003 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
32 |
10 |
11389 |
336.7 |
-5.4 |
0.144 |
2 |
0 |
0 |
0.000 |
4 |
4 |
|
[NXL]A:701 |
17 |
1 |
383 |
cf |
A |
x,y,z |
1_555 |
27 |
15 |
11389 |
233.6 |
-1.1 |
0.385 |
9 |
0 |
0 |
0.095 |
5 |
|
[NXL]B:308 |
17 |
1 |
390 |
cf |
B |
x,y,z |
1_555 |
32 |
16 |
11003 |
232.9 |
-1.1 |
0.449 |
10 |
0 |
0 |
0.095 |
Average: |
233.3 |
-1.1 |
0.417 |
10 |
0 |
0 |
0.095 |
5 |
6 |
|
[GOL]A:706 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
23 |
12 |
11389 |
142.9 |
-1.2 |
0.432 |
2 |
0 |
0 |
0.018 |
6 |
7 |
|
[GOL]A:705 |
6 |
1 |
221 |
f |
A |
x,y,z |
1_555 |
18 |
7 |
11389 |
116.7 |
0.1 |
0.549 |
3 |
0 |
0 |
0.011 |
7 |
8 |
|
[GOL]A:703 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
17 |
9 |
11389 |
112.5 |
-0.6 |
0.528 |
3 |
0 |
0 |
0.017 |
8 |
9 |
|
[GOL]A:702 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
17 |
7 |
11389 |
103.9 |
-0.1 |
0.546 |
4 |
0 |
0 |
0.035 |
10 |
|
[GOL]B:301 |
6 |
1 |
218 |
f |
B |
x,y,z |
1_555 |
16 |
7 |
11003 |
103.9 |
-0.2 |
0.571 |
4 |
0 |
0 |
0.035 |
Average: |
103.9 |
-0.2 |
0.558 |
4 |
0 |
0 |
0.035 |
9 |
11 |
|
[GOL]A:704 |
6 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
11389 |
95.0 |
0.8 |
0.728 |
2 |
0 |
0 |
0.001 |
10 |
12 |
|
[IOD]B:307 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
16 |
11 |
11003 |
86.9 |
-0.0 |
0.763 |
0 |
0 |
0 |
0.000 |
11 |
13 |
|
[NA]A:708 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
17 |
9 |
11389 |
80.3 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.107 |
12 |
14 |
|
[IOD]B:304 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
15 |
4 |
11003 |
78.8 |
0.2 |
0.824 |
0 |
0 |
0 |
0.000 |
15 |
|
[IOD]A:714 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
14 |
4 |
11389 |
78.3 |
0.2 |
0.786 |
0 |
0 |
0 |
0.000 |
Average: |
78.6 |
0.2 |
0.805 |
0 |
0 |
0 |
0.000 |
13 |
16 |
|
[GOL]B:301 |
5 |
1 |
218 |
◊ |
A |
x,y,z |
1_555 |
12 |
4 |
11389 |
78.0 |
-0.2 |
0.523 |
3 |
0 |
0 |
0.024 |
17 |
|
[GOL]A:702 |
5 |
1 |
219 |
◊ |
B |
x,y,z |
1_555 |
12 |
4 |
11003 |
77.6 |
-0.3 |
0.549 |
2 |
0 |
0 |
0.024 |
Average: |
77.8 |
-0.2 |
0.536 |
3 |
0 |
0 |
0.024 |
14 |
18 |
|
[IOD]B:305 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
17 |
7 |
11003 |
77.9 |
0.1 |
0.813 |
0 |
0 |
0 |
0.000 |
15 |
19 |
|
[IOD]A:712 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
11389 |
75.7 |
0.1 |
0.760 |
0 |
0 |
0 |
0.000 |
16 |
20 |
|
[IOD]B:306 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
11003 |
75.1 |
-0.3 |
0.685 |
0 |
0 |
0 |
0.005 |
21 |
|
[IOD]A:713 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
14 |
7 |
11389 |
68.6 |
-0.3 |
0.670 |
0 |
0 |
0 |
0.005 |
Average: |
71.9 |
-0.3 |
0.677 |
0 |
0 |
0 |
0.005 |
17 |
22 |
|
[NA]A:711 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
7 |
11389 |
74.1 |
-10.8 |
0.000 |
0 |
0 |
0 |
0.097 |
18 |
23 |
|
[NA]B:302 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
14 |
7 |
11003 |
71.7 |
-9.6 |
0.000 |
0 |
0 |
0 |
0.086 |
19 |
24 |
|
[NA]A:707 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
18 |
8 |
11389 |
71.7 |
-10.1 |
0.000 |
0 |
0 |
0 |
0.090 |
20 |
25 |
|
[CL]B:303 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
11003 |
64.7 |
-9.1 |
0.000 |
0 |
0 |
0 |
0.081 |
21 |
26 |
|
[NA]A:710 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
11389 |
63.9 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.082 |
22 |
27 |
|
[NA]A:709 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
11389 |
63.7 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.077 |
23 |
28 |
|
[IOD]A:715 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
12 |
4 |
11389 |
57.4 |
-0.1 |
0.710 |
0 |
0 |
0 |
0.000 |
24 |
29 |
|
A |
5 |
2 |
11389 |
◊ |
[GOL]A:704 |
x-1/2,-y-1/2,-z |
4_445 |
5 |
1 |
216 |
52.3 |
0.3 |
0.701 |
1 |
0 |
0 |
0.000 |
25 |
30 |
|
A |
9 |
2 |
11389 |
◊ |
[GOL]A:705 |
x-1/2,-y-1/2,-z |
4_445 |
5 |
1 |
221 |
50.9 |
-0.0 |
0.528 |
0 |
0 |
0 |
0.000 |
26 |
31 |
|
[IOD]A:715 |
1 |
1 |
144 |
f |
A |
x-1/2,-y-1/2,-z |
4_445 |
11 |
4 |
11389 |
50.5 |
-0.4 |
0.608 |
0 |
0 |
0 |
0.003 |
27 |
32 |
|
[IOD]A:713 |
1 |
1 |
144 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
10 |
4 |
11389 |
44.3 |
-0.2 |
0.651 |
0 |
0 |
0 |
0.000 |
28 |
33 |
|
[IOD]B:305 |
1 |
1 |
144 |
f |
[NXL]B:308 |
x,y,z |
1_555 |
6 |
1 |
390 |
39.6 |
-0.1 |
0.620 |
0 |
0 |
0 |
0.000 |
29 |
34 |
|
[NXL]A:701 |
4 |
1 |
383 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
6 |
2 |
11389 |
38.4 |
0.1 |
0.519 |
0 |
0 |
0 |
0.000 |
30 |
35 |
|
[IOD]A:712 |
1 |
1 |
144 |
f |
[NXL]A:701 |
x,y,z |
1_555 |
4 |
1 |
383 |
19.9 |
-0.2 |
0.586 |
0 |
0 |
0 |
0.002 |
31 |
36 |
|
[IOD]A:715 |
1 |
1 |
144 |
◊ |
[NXL]A:701 |
x,y,z |
1_555 |
3 |
1 |
383 |
19.5 |
0.2 |
0.777 |
0 |
0 |
0 |
0.000 |
32 |
37 |
|
[IOD]B:304 |
1 |
1 |
144 |
f |
[NXL]B:308 |
x,y,z |
1_555 |
1 |
1 |
390 |
2.7 |
0.0 |
0.728 |
0 |
0 |
0 |
0.000 |
38 |
|
[IOD]A:714 |
1 |
1 |
144 |
f |
[NXL]A:701 |
x,y,z |
1_555 |
1 |
1 |
383 |
1.5 |
0.0 |
0.728 |
0 |
0 |
0 |
0.000 |
Average: |
2.1 |
0.0 |
0.728 |
0 |
0 |
0 |
0.000 |
|