| ## |
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 |
229 |
64 |
14905 |
◊ |
A |
x,y,z |
1_555 |
227 |
63 |
14654 |
2197.1 |
-32.8 |
0.006 |
20 |
8 |
0 |
0.091 |
| 2 |
2 |
|
A |
54 |
12 |
14654 |
◊ |
A |
-x+1,y,-z+1/2 |
4_655 |
54 |
12 |
14654 |
500.6 |
-0.8 |
0.679 |
6 |
12 |
0 |
0.001 |
3 |
|
B |
54 |
12 |
14905 |
◊ |
B |
-x+1,y,-z+1/2 |
4_655 |
54 |
12 |
14905 |
499.2 |
-0.7 |
0.657 |
6 |
12 |
0 |
0.001 |
| Average: |
499.9 |
-0.8 |
0.668 |
6 |
12 |
0 |
0.001 |
| 3 |
4 |
|
A |
26 |
8 |
14654 |
◊ |
B |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
31 |
8 |
14905 |
287.3 |
-0.5 |
0.625 |
0 |
0 |
0 |
0.000 |
| 4 |
5 |
|
B |
24 |
9 |
14905 |
◊ |
A |
-x+1,y,-z+1/2 |
4_655 |
26 |
10 |
14654 |
286.5 |
-0.4 |
0.609 |
2 |
0 |
0 |
0.000 |
| 5 |
6 |
|
B |
25 |
10 |
14905 |
◊ |
A |
-x+1/2,y-1/2,-z+1/2 |
8_545 |
30 |
9 |
14654 |
261.0 |
-3.5 |
0.255 |
1 |
0 |
0 |
0.000 |
| 6 |
7 |
|
[PLP]B:400 |
15 |
1 |
381 |
f |
B |
x,y,z |
1_555 |
41 |
21 |
14905 |
218.7 |
0.8 |
0.627 |
10 |
0 |
0 |
0.013 |
8 |
|
[PLP]A:400 |
15 |
1 |
381 |
cf |
A |
x,y,z |
1_555 |
44 |
22 |
14654 |
213.0 |
1.6 |
0.676 |
9 |
0 |
0 |
0.013 |
| Average: |
215.8 |
1.2 |
0.651 |
10 |
0 |
0 |
0.013 |
| 7 |
9 |
|
[K]B:502 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
16 |
7 |
14905 |
116.6 |
-88.2 |
0.000 |
0 |
0 |
0 |
0.371 |
10 |
|
[K]A:502 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
14654 |
116.0 |
-87.6 |
0.000 |
0 |
0 |
0 |
0.371 |
| Average: |
116.3 |
-87.9 |
0.000 |
0 |
0 |
0 |
0.371 |
| 8 |
11 |
|
[GOL]B:403 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
16 |
7 |
14905 |
92.3 |
-0.8 |
0.454 |
1 |
0 |
0 |
0.005 |
12 |
|
[GOL]A:403 |
6 |
1 |
221 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
14654 |
91.3 |
-1.3 |
0.410 |
0 |
0 |
0 |
0.005 |
| Average: |
91.8 |
-1.0 |
0.432 |
1 |
0 |
0 |
0.005 |
| 9 |
13 |
|
[GOL]A:403 |
5 |
1 |
221 |
◊ |
B |
x,y,z |
1_555 |
14 |
4 |
14905 |
89.6 |
-0.5 |
0.450 |
0 |
0 |
0 |
0.002 |
14 |
|
[GOL]B:403 |
6 |
1 |
220 |
◊ |
A |
x,y,z |
1_555 |
14 |
4 |
14654 |
88.5 |
-0.5 |
0.445 |
0 |
0 |
0 |
0.002 |
| Average: |
89.0 |
-0.5 |
0.447 |
0 |
0 |
0 |
0.002 |
| 10 |
15 |
|
[K]B:501 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
9 |
6 |
14905 |
84.9 |
-82.0 |
0.000 |
0 |
0 |
0 |
0.173 |
| 11 |
16 |
|
[PO4]B:402 |
5 |
1 |
189 |
f |
B |
x,y,z |
1_555 |
22 |
14 |
14905 |
83.9 |
-3.7 |
0.821 |
8 |
0 |
0 |
0.015 |
| 12 |
17 |
|
[PO4]A:402 |
5 |
1 |
189 |
f |
A |
x,y,z |
1_555 |
22 |
13 |
14654 |
80.4 |
-3.7 |
0.825 |
10 |
0 |
0 |
0.017 |
| 13 |
18 |
|
A |
8 |
2 |
14654 |
◊ |
A |
-x,y,-z+1/2 |
4_555 |
8 |
2 |
14654 |
71.7 |
-1.5 |
0.251 |
0 |
0 |
0 |
0.000 |
| 14 |
19 |
|
[PO4]B:402 |
5 |
1 |
189 |
f |
[PLP]B:400 |
x,y,z |
1_555 |
6 |
1 |
381 |
63.2 |
-5.8 |
0.413 |
0 |
0 |
0 |
0.012 |
| 15 |
20 |
|
[PO4]A:402 |
5 |
1 |
189 |
f |
[PLP]A:400 |
x,y,z |
1_555 |
7 |
1 |
381 |
61.5 |
-5.7 |
0.468 |
0 |
0 |
0 |
0.012 |
| 16 |
21 |
|
[NA]B:500 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
14905 |
58.8 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.037 |
22 |
|
[NA]A:500 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
7 |
14654 |
56.9 |
-8.7 |
0.000 |
0 |
0 |
0 |
0.037 |
| Average: |
57.8 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.037 |
| 17 |
23 |
|
[CL]A:504 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
6 |
6 |
14654 |
55.2 |
-10.9 |
0.000 |
0 |
0 |
0 |
0.023 |
| 18 |
24 |
|
[CL]A:503 |
1 |
1 |
125 |
f |
[K]A:501 |
x,y,z |
1_555 |
1 |
1 |
216 |
45.4 |
-23.9 |
0.000 |
0 |
0 |
0 |
0.050 |
| 19 |
25 |
|
[CL]B:503 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
9 |
6 |
14905 |
42.7 |
-8.0 |
0.000 |
0 |
0 |
0 |
0.017 |
| 20 |
26 |
|
[NA]B:500 |
1 |
1 |
125 |
f |
[PLP]B:400 |
x,y,z |
1_555 |
4 |
1 |
381 |
35.3 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.014 |
27 |
|
[NA]A:500 |
1 |
1 |
125 |
f |
[PLP]A:400 |
x,y,z |
1_555 |
3 |
1 |
381 |
35.2 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.014 |
| Average: |
35.2 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.014 |
| 21 |
28 |
|
[CL]B:503 |
1 |
1 |
125 |
f |
[K]B:501 |
x,y,z |
1_555 |
1 |
1 |
216 |
32.8 |
-17.9 |
0.000 |
0 |
0 |
0 |
0.038 |
| 22 |
29 |
|
[K]A:502 |
1 |
1 |
216 |
f |
[K]A:501 |
x,y,z |
1_555 |
1 |
1 |
216 |
20.6 |
-20.6 |
0.000 |
0 |
0 |
0 |
0.043 |
| 23 |
30 |
|
[K]B:502 |
1 |
1 |
216 |
f |
[K]B:501 |
x,y,z |
1_555 |
1 |
1 |
216 |
20.1 |
-20.1 |
0.000 |
0 |
0 |
0 |
0.042 |
| 24 |
31 |
|
[CL]A:504 |
1 |
1 |
125 |
f |
[CL]A:503 |
x,y,z |
1_555 |
1 |
1 |
125 |
12.3 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.005 |
| 25 |
32 |
|
[CL]B:504 |
1 |
1 |
125 |
f |
[CL]B:503 |
x,y,z |
1_555 |
1 |
1 |
125 |
10.5 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.004 |
| 26 |
33 |
|
[CL]B:504 |
1 |
1 |
125 |
f |
[K]B:501 |
x,y,z |
1_555 |
1 |
1 |
216 |
7.4 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.009 |
| 27 |
34 |
|
[CL]A:504 |
1 |
1 |
125 |
f |
[K]A:501 |
x,y,z |
1_555 |
1 |
1 |
216 |
4.9 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.006 |
| 28 |
35 |
|
A |
1 |
1 |
14654 |
x |
A |
-x+1/2,y-1/2,-z+1/2 |
8_545 |
2 |
1 |
14654 |
1.6 |
-0.1 |
0.529 |
0 |
0 |
0 |
0.000 |
|