## |
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 |
111 |
32 |
17939 |
◊ |
A |
x,y,z |
1_555 |
115 |
31 |
17937 |
1022.9 |
-16.6 |
0.011 |
3 |
0 |
0 |
0.126 |
2 |
2 |
|
B |
35 |
11 |
17939 |
◊ |
A |
-x,y-1/2,-z+1 |
2_546 |
22 |
5 |
17937 |
264.7 |
0.3 |
0.602 |
0 |
2 |
0 |
0.000 |
3 |
3 |
|
A |
34 |
11 |
17937 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
25 |
6 |
17939 |
254.7 |
-0.9 |
0.469 |
1 |
1 |
0 |
0.000 |
4 |
4 |
|
B |
16 |
5 |
17939 |
x |
B |
-x,y-1/2,-z+1 |
2_546 |
32 |
8 |
17939 |
223.5 |
-5.3 |
0.028 |
0 |
0 |
0 |
0.000 |
5 |
5 |
|
A |
18 |
5 |
17937 |
x |
A |
-x+1,y-1/2,-z+1 |
2_646 |
30 |
7 |
17937 |
218.7 |
-4.8 |
0.048 |
1 |
0 |
0 |
0.000 |
6 |
6 |
|
B |
24 |
7 |
17939 |
x |
B |
x-1,y,z |
1_455 |
21 |
6 |
17939 |
194.6 |
0.5 |
0.630 |
2 |
0 |
0 |
0.000 |
7 |
7 |
|
A |
15 |
3 |
17937 |
◊ |
B |
x,y,z-1 |
1_554 |
14 |
2 |
17939 |
140.3 |
0.8 |
0.690 |
0 |
0 |
0 |
0.000 |
8 |
8 |
|
[ACT]A:340 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
24 |
13 |
17937 |
126.9 |
-0.6 |
0.600 |
4 |
0 |
0 |
0.034 |
9 |
|
[ACT]B:345 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
22 |
13 |
17939 |
117.2 |
-0.7 |
0.591 |
4 |
0 |
0 |
0.034 |
Average: |
122.0 |
-0.7 |
0.595 |
4 |
0 |
0 |
0.034 |
9 |
10 |
|
[GOL]A:341 |
6 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
20 |
7 |
17939 |
115.5 |
-1.8 |
0.321 |
0 |
0 |
0 |
0.013 |
10 |
11 |
|
[PO4]B:338 |
5 |
1 |
189 |
f |
B |
x,y,z |
1_555 |
20 |
8 |
17939 |
111.8 |
-7.4 |
0.586 |
2 |
0 |
0 |
0.059 |
11 |
12 |
|
[PO4]B:344 |
5 |
1 |
189 |
f |
B |
x,y,z |
1_555 |
15 |
8 |
17939 |
102.7 |
-5.6 |
0.778 |
4 |
0 |
0 |
0.052 |
12 |
13 |
|
[PO4]A:339 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
17937 |
100.3 |
-5.6 |
0.749 |
4 |
0 |
0 |
0.052 |
13 |
14 |
|
A |
12 |
4 |
17937 |
x |
A |
x-1,y,z |
1_455 |
10 |
3 |
17937 |
99.0 |
-0.0 |
0.519 |
1 |
0 |
0 |
0.000 |
14 |
15 |
|
[NA]B:341 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
17 |
8 |
17939 |
77.5 |
-10.9 |
0.000 |
0 |
0 |
0 |
0.077 |
15 |
16 |
|
[GOL]A:341 |
4 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
11 |
3 |
17937 |
74.8 |
-0.6 |
0.436 |
2 |
0 |
0 |
0.010 |
16 |
17 |
|
[CL]B:339 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
12 |
9 |
17939 |
66.1 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.062 |
17 |
18 |
|
[NA]A:337 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
17937 |
65.4 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.061 |
18 |
19 |
|
B |
8 |
3 |
17939 |
◊ |
A |
x-1,y,z+1 |
1_456 |
8 |
3 |
17937 |
64.6 |
0.7 |
0.718 |
0 |
0 |
0 |
0.000 |
19 |
20 |
|
[CL]B:337 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
11 |
3 |
17939 |
63.3 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.047 |
20 |
21 |
|
[CL]B:343 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
13 |
4 |
17939 |
62.1 |
-7.9 |
0.000 |
0 |
0 |
0 |
0.055 |
21 |
22 |
|
[NI]A:336 |
1 |
1 |
115 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
17937 |
57.4 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.118 |
23 |
|
[NI]B:336 |
1 |
1 |
115 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
17939 |
54.9 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.118 |
Average: |
56.1 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.118 |
22 |
24 |
|
[CL]B:340 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
8 |
3 |
17939 |
55.8 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.055 |
23 |
25 |
|
[CL]B:342 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
17939 |
54.3 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.055 |
24 |
26 |
|
[CL]A:338 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
6 |
2 |
17937 |
48.4 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.036 |
25 |
27 |
|
[CL]B:337 |
1 |
1 |
125 |
◊ |
A |
x-1,y,z+1 |
1_456 |
4 |
2 |
17937 |
30.7 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.000 |
26 |
28 |
|
[CL]A:338 |
1 |
1 |
125 |
f |
[NA]A:337 |
x,y,z |
1_555 |
1 |
1 |
125 |
27.4 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.039 |
27 |
29 |
|
[ACT]B:345 |
2 |
1 |
183 |
f |
[CL]B:339 |
x,y,z |
1_555 |
1 |
1 |
125 |
25.1 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.021 |
28 |
30 |
|
B |
4 |
3 |
17939 |
◊ |
A |
x-1,y,z |
1_455 |
6 |
3 |
17937 |
23.7 |
-0.5 |
0.409 |
0 |
0 |
0 |
0.000 |
29 |
31 |
|
[CL]B:339 |
1 |
1 |
125 |
f |
[NI]B:336 |
x,y,z |
1_555 |
1 |
1 |
115 |
13.8 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.019 |
30 |
32 |
|
[ACT]B:345 |
1 |
1 |
183 |
f |
[NI]B:336 |
x,y,z |
1_555 |
1 |
1 |
115 |
6.5 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.009 |
33 |
|
[ACT]A:340 |
1 |
1 |
182 |
f |
[NI]A:336 |
x,y,z |
1_555 |
1 |
1 |
115 |
4.9 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.009 |
Average: |
5.7 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.009 |
31 |
34 |
|
B |
1 |
1 |
17939 |
◊ |
[PO4]B:338 |
x-1,y,z |
1_455 |
2 |
1 |
189 |
3.6 |
-0.1 |
0.852 |
0 |
0 |
0 |
0.000 |
|