## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
[ADP]A:1322 |
27 |
1 |
545 |
f |
A |
x,y,z |
1_555 |
51 |
19 |
31929 |
381.9 |
-4.8 |
0.659 |
13 |
0 |
0 |
0.006 |
2 |
|
A |
54 |
17 |
31929 |
x |
A |
-x,y-1/2,-z+1/2 |
3_545 |
42 |
14 |
31929 |
376.0 |
0.1 |
0.644 |
2 |
5 |
0 |
0.000 |
3 |
|
[MPD]A:1312 |
7 |
1 |
278 |
f |
A |
x,y,z |
1_555 |
26 |
12 |
31929 |
188.8 |
-12.4 |
0.493 |
1 |
0 |
0 |
0.007 |
4 |
|
[MPD]A:1301 |
7 |
1 |
273 |
f |
A |
x,y,z |
1_555 |
30 |
13 |
31929 |
187.6 |
-10.7 |
0.750 |
0 |
0 |
0 |
0.006 |
5 |
|
[MPD]A:1305 |
7 |
1 |
276 |
f |
A |
x,y,z |
1_555 |
22 |
11 |
31929 |
168.4 |
-11.0 |
0.500 |
3 |
0 |
0 |
0.006 |
6 |
|
[MPD]A:1304 |
7 |
1 |
273 |
f |
A |
x,y,z |
1_555 |
21 |
9 |
31929 |
160.9 |
-11.2 |
0.408 |
1 |
0 |
0 |
0.006 |
7 |
|
[MPD]A:1307 |
7 |
1 |
280 |
f |
A |
x,y,z |
1_555 |
22 |
9 |
31929 |
147.4 |
-8.5 |
0.753 |
2 |
0 |
0 |
0.005 |
8 |
|
[MPD]A:1311 |
7 |
1 |
281 |
f |
A |
x,y,z |
1_555 |
18 |
6 |
31929 |
138.8 |
-8.6 |
0.617 |
0 |
0 |
0 |
0.005 |
9 |
|
[PEG]A:1313 |
7 |
1 |
264 |
f |
A |
x,y,z |
1_555 |
24 |
9 |
31929 |
138.5 |
3.3 |
0.380 |
2 |
0 |
0 |
0.000 |
10 |
|
[MPD]A:1310 |
7 |
1 |
278 |
f |
A |
x,y,z |
1_555 |
17 |
7 |
31929 |
126.3 |
-6.5 |
0.886 |
0 |
0 |
0 |
0.003 |
11 |
|
[MPD]A:1302 |
6 |
1 |
277 |
f |
A |
x,y,z |
1_555 |
20 |
8 |
31929 |
126.2 |
-6.8 |
0.832 |
0 |
0 |
0 |
0.004 |
12 |
|
[MPD]A:1309 |
7 |
1 |
280 |
f |
A |
x,y,z |
1_555 |
18 |
8 |
31929 |
109.5 |
-6.2 |
0.737 |
1 |
0 |
0 |
0.003 |
13 |
|
[SO4]A:1321 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
19 |
9 |
31929 |
101.7 |
-14.8 |
0.784 |
3 |
0 |
0 |
0.008 |
14 |
|
[MPD]A:1303 |
6 |
1 |
277 |
f |
A |
x,y,z |
1_555 |
17 |
6 |
31929 |
92.4 |
-4.9 |
0.838 |
2 |
0 |
0 |
0.003 |
15 |
|
[BEF]A:1323 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
23 |
10 |
31929 |
84.6 |
4.1 |
0.971 |
5 |
0 |
0 |
0.000 |
16 |
|
[PEG]A:1306 |
7 |
1 |
261 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
31929 |
77.8 |
0.9 |
0.139 |
0 |
0 |
0 |
0.000 |
17 |
|
[SO4]A:1320 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
31929 |
74.5 |
-11.3 |
0.510 |
0 |
0 |
0 |
0.006 |
18 |
|
[MPD]A:1308 |
5 |
1 |
278 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
31929 |
72.0 |
-3.9 |
0.734 |
0 |
0 |
0 |
0.002 |
19 |
|
[CL]A:1315 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
14 |
7 |
31929 |
68.1 |
-9.6 |
0.000 |
0 |
0 |
0 |
0.005 |
20 |
|
[CL]A:1316 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
31929 |
67.9 |
-11.1 |
0.000 |
0 |
0 |
0 |
0.006 |
21 |
|
[CL]A:1314 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
6 |
31929 |
64.4 |
-8.7 |
0.000 |
0 |
0 |
0 |
0.005 |
22 |
|
[CL]A:1317 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
31929 |
63.1 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.004 |
23 |
|
[SO4]A:1321 |
4 |
1 |
185 |
f |
[MPD]A:1301 |
x,y,z |
1_555 |
3 |
1 |
273 |
46.6 |
-7.8 |
0.000 |
1 |
0 |
0 |
0.004 |
24 |
|
[MPD]A:1308 |
5 |
1 |
278 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
3 |
1 |
31929 |
45.9 |
-1.0 |
0.982 |
1 |
0 |
0 |
0.000 |
25 |
|
[BEF]A:1323 |
4 |
1 |
183 |
f |
[ADP]A:1322 |
x,y,z |
1_555 |
5 |
1 |
545 |
39.8 |
-1.8 |
0.316 |
0 |
0 |
0 |
0.000 |
26 |
|
[MG]A:1319 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
31929 |
35.9 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.003 |
27 |
|
[ADP]A:1322 |
4 |
1 |
545 |
f |
[MG]A:1319 |
x,y,z |
1_555 |
1 |
1 |
98 |
25.1 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.002 |
28 |
|
[CL]A:1318 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
3 |
2 |
31929 |
22.3 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.001 |
29 |
|
[BEF]A:1323 |
3 |
1 |
183 |
f |
[MG]A:1319 |
x,y,z |
1_555 |
1 |
1 |
98 |
21.9 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.000 |
30 |
|
[SO4]A:1320 |
4 |
1 |
186 |
f |
[PEG]A:1306 |
x,y,z |
1_555 |
2 |
1 |
261 |
16.0 |
-1.6 |
0.350 |
0 |
0 |
0 |
0.000 |
31 |
|
A |
2 |
1 |
31929 |
◊ |
[MPD]A:1305 |
-x,y-1/2,-z+1/2 |
3_545 |
3 |
1 |
276 |
15.1 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.000 |
32 |
|
[CL]A:1316 |
1 |
1 |
125 |
f |
[CL]A:1315 |
x,y,z |
1_555 |
1 |
1 |
125 |
5.5 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.000 |
|