| ## |
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 |
|
B |
949 |
227 |
52451 |
◊ |
A |
x,y,z |
1_555 |
976 |
258 |
70480 |
9399.8 |
-95.0 |
0.021 |
132 |
26 |
0 |
0.595 |
2 |
|
S |
261 |
70 |
11730 |
◊ |
A |
x,y,z |
1_555 |
286 |
82 |
70480 |
2615.5 |
-17.7 |
0.506 |
29 |
10 |
0 |
0.240 |
3 |
|
G |
233 |
64 |
9931 |
◊ |
D |
x,y,z |
1_555 |
233 |
65 |
12177 |
2250.6 |
-18.7 |
0.194 |
25 |
15 |
0 |
1.000 |
4 |
|
K |
197 |
47 |
8665 |
◊ |
C |
x,y,z |
1_555 |
206 |
52 |
16399 |
2109.2 |
-31.8 |
0.045 |
14 |
5 |
0 |
1.000 |
5 |
|
E |
202 |
47 |
12761 |
◊ |
A |
x,y,z |
1_555 |
235 |
69 |
70480 |
2084.6 |
-12.5 |
0.329 |
27 |
9 |
0 |
0.204 |
6 |
|
F |
215 |
56 |
5739 |
◊ |
A |
x,y,z |
1_555 |
211 |
52 |
70480 |
1896.0 |
-18.8 |
0.307 |
20 |
8 |
0 |
0.228 |
7 |
|
C |
192 |
46 |
16399 |
◊ |
B |
x,y,z |
1_555 |
187 |
47 |
52451 |
1699.1 |
-6.3 |
0.628 |
31 |
12 |
0 |
0.356 |
8 |
|
I |
168 |
39 |
9384 |
◊ |
A |
x,y,z |
1_555 |
174 |
45 |
70480 |
1574.7 |
-14.5 |
0.214 |
22 |
5 |
0 |
0.198 |
9 |
|
H |
168 |
41 |
8545 |
◊ |
A |
x,y,z |
1_555 |
156 |
44 |
70480 |
1537.4 |
-19.4 |
0.067 |
19 |
7 |
0 |
0.228 |
10 |
|
J |
146 |
33 |
5026 |
◊ |
B |
x,y,z |
1_555 |
179 |
55 |
52451 |
1537.3 |
-18.1 |
0.187 |
18 |
4 |
0 |
1.000 |
11 |
|
I |
141 |
37 |
9384 |
◊ |
B |
x,y,z |
1_555 |
119 |
32 |
52451 |
1167.9 |
-12.1 |
0.229 |
5 |
2 |
0 |
0.055 |
12 |
|
J |
95 |
26 |
5026 |
◊ |
C |
x,y,z |
1_555 |
123 |
38 |
16399 |
1100.8 |
-5.7 |
0.563 |
13 |
9 |
0 |
0.209 |
13 |
|
L |
92 |
23 |
4553 |
◊ |
B |
x,y,z |
1_555 |
116 |
36 |
52451 |
1028.6 |
-1.9 |
0.710 |
16 |
11 |
0 |
0.030 |
14 |
|
K |
104 |
26 |
8665 |
◊ |
A |
x,y,z |
1_555 |
105 |
27 |
70480 |
998.6 |
-7.8 |
0.399 |
9 |
2 |
0 |
0.035 |
15 |
|
G |
82 |
22 |
9931 |
◊ |
G |
-x+1,y,-z-1/2 |
3_654 |
81 |
22 |
9931 |
836.3 |
-5.2 |
0.426 |
9 |
0 |
0 |
0.013 |
16 |
|
T |
80 |
8 |
3078 |
◊ |
A |
x,y,z |
1_555 |
75 |
21 |
70480 |
641.7 |
-5.2 |
0.752 |
5 |
0 |
0 |
0.019 |
17 |
|
L |
53 |
11 |
4553 |
◊ |
C |
x,y,z |
1_555 |
77 |
22 |
16399 |
603.1 |
-0.5 |
0.705 |
10 |
5 |
0 |
0.016 |
18 |
|
G |
70 |
19 |
9931 |
◊ |
A |
x,y,z |
1_555 |
59 |
15 |
70480 |
600.2 |
-9.6 |
0.066 |
6 |
5 |
0 |
0.061 |
19 |
|
I |
59 |
15 |
9384 |
◊ |
A |
x-1/2,-y+1/2,-z |
8_455 |
59 |
15 |
70480 |
537.4 |
1.5 |
0.711 |
10 |
4 |
0 |
0.000 |
20 |
|
K |
43 |
14 |
8665 |
◊ |
B |
x,y,z |
1_555 |
54 |
17 |
52451 |
484.0 |
-2.1 |
0.642 |
3 |
3 |
0 |
0.037 |
21 |
|
G |
51 |
13 |
9931 |
◊ |
F |
x,y,z |
1_555 |
44 |
17 |
5739 |
454.9 |
-5.4 |
0.302 |
4 |
1 |
0 |
0.035 |
22 |
|
C |
44 |
10 |
16399 |
◊ |
A |
x,y,z |
1_555 |
39 |
13 |
70480 |
361.1 |
-1.4 |
0.604 |
3 |
0 |
0 |
0.010 |
23 |
|
C |
41 |
12 |
16399 |
◊ |
A |
x,-y,-z |
4_555 |
39 |
10 |
70480 |
348.0 |
-1.3 |
0.512 |
6 |
0 |
0 |
0.000 |
24 |
|
T |
33 |
8 |
3078 |
◊ |
N |
x,y,z |
1_555 |
35 |
7 |
1820 |
346.9 |
-5.1 |
0.508 |
19 |
0 |
0 |
1.000 |
25 |
|
S |
32 |
10 |
11730 |
◊ |
B |
x,y,z |
1_555 |
39 |
12 |
52451 |
296.3 |
0.4 |
0.552 |
6 |
0 |
0 |
0.008 |
26 |
|
D |
29 |
9 |
12177 |
◊ |
A |
-x+1,y,-z-1/2 |
3_654 |
34 |
10 |
70480 |
295.7 |
3.1 |
0.905 |
3 |
5 |
0 |
0.000 |
27 |
|
N |
26 |
6 |
1820 |
◊ |
A |
x,y,z |
1_555 |
32 |
14 |
70480 |
217.0 |
-4.0 |
0.384 |
2 |
0 |
0 |
0.012 |
28 |
|
D |
23 |
6 |
12177 |
◊ |
B |
x,y,z |
1_555 |
29 |
10 |
52451 |
211.3 |
-2.2 |
0.411 |
0 |
0 |
0 |
0.005 |
29 |
|
P |
23 |
5 |
1387 |
◊ |
T |
x,y,z |
1_555 |
20 |
4 |
3078 |
210.0 |
-2.9 |
0.643 |
13 |
0 |
0 |
0.390 |
30 |
|
P |
23 |
5 |
1387 |
◊ |
B |
x,y,z |
1_555 |
23 |
13 |
52451 |
208.0 |
-5.4 |
0.438 |
6 |
0 |
0 |
0.020 |
31 |
|
K |
19 |
6 |
8665 |
◊ |
H |
x,y,z |
1_555 |
19 |
6 |
8545 |
200.7 |
-1.0 |
0.571 |
1 |
0 |
0 |
0.003 |
32 |
|
T |
23 |
4 |
3078 |
◊ |
B |
x,y,z |
1_555 |
26 |
12 |
52451 |
192.5 |
-5.3 |
0.319 |
2 |
0 |
0 |
0.015 |
33 |
|
P |
20 |
2 |
1387 |
◊ |
A |
x,y,z |
1_555 |
24 |
8 |
70480 |
180.0 |
-1.6 |
0.682 |
3 |
0 |
0 |
0.007 |
34 |
|
[EPE]A:1735 |
14 |
1 |
399 |
◊ |
A |
x,y,z |
1_555 |
22 |
9 |
70480 |
177.3 |
6.7 |
0.100 |
4 |
0 |
0 |
0.000 |
35 |
|
H |
18 |
5 |
8545 |
◊ |
C |
x,y,z |
1_555 |
23 |
5 |
16399 |
170.2 |
-1.7 |
0.379 |
0 |
0 |
0 |
0.005 |
36 |
|
D |
17 |
5 |
12177 |
◊ |
A |
x,y,z |
1_555 |
16 |
6 |
70480 |
155.1 |
-2.1 |
0.296 |
1 |
1 |
0 |
0.012 |
37 |
|
[BRU]T:22 |
7 |
1 |
452 |
◊ |
B |
x,y,z |
1_555 |
17 |
9 |
52451 |
133.2 |
-2.5 |
0.297 |
3 |
0 |
0 |
0.009 |
38 |
|
F |
16 |
6 |
5739 |
◊ |
E |
x,y,z |
1_555 |
12 |
3 |
12761 |
130.6 |
0.0 |
0.592 |
1 |
3 |
0 |
0.007 |
39 |
|
[BRU]T:22 |
14 |
1 |
452 |
cf |
T |
x,y,z |
1_555 |
14 |
1 |
3078 |
119.5 |
1.7 |
0.677 |
0 |
0 |
0 |
0.000 |
40 |
|
[PGE]L:71 |
9 |
1 |
336 |
◊ |
L |
x,y,z |
1_555 |
16 |
6 |
4553 |
114.8 |
2.3 |
0.185 |
2 |
0 |
0 |
0.000 |
41 |
|
[ACT]A:1734 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
14 |
7 |
70480 |
108.6 |
-1.7 |
0.482 |
1 |
0 |
0 |
0.017 |
42 |
|
G |
11 |
4 |
9931 |
◊ |
B |
x,y,z |
1_555 |
15 |
5 |
52451 |
103.0 |
-0.6 |
0.457 |
0 |
0 |
0 |
0.002 |
43 |
|
P |
11 |
1 |
1387 |
◊ |
S |
x,y,z |
1_555 |
12 |
3 |
11730 |
102.2 |
-0.5 |
0.669 |
2 |
0 |
0 |
0.000 |
44 |
|
L |
12 |
5 |
4553 |
◊ |
B |
x,-y,-z |
4_555 |
14 |
6 |
52451 |
91.9 |
-0.4 |
0.538 |
1 |
0 |
0 |
0.000 |
45 |
|
[EPE]A:1735 |
10 |
1 |
399 |
◊ |
D |
-x+1,y,-z-1/2 |
3_654 |
9 |
3 |
12177 |
89.9 |
1.4 |
0.015 |
0 |
0 |
0 |
0.000 |
46 |
|
F |
11 |
5 |
5739 |
◊ |
B |
x,y,z |
1_555 |
11 |
6 |
52451 |
81.9 |
-0.0 |
0.644 |
0 |
0 |
0 |
0.000 |
47 |
|
[ACT]B:1225 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
15 |
5 |
52451 |
80.5 |
-0.6 |
0.600 |
0 |
0 |
0 |
0.001 |
48 |
|
L |
8 |
6 |
4553 |
◊ |
J |
x,y,z |
1_555 |
7 |
2 |
5026 |
75.0 |
-1.1 |
0.316 |
0 |
0 |
0 |
0.003 |
49 |
|
[PGE]L:71 |
6 |
1 |
336 |
◊ |
[PGE]L:71 |
x,-y,-z |
4_555 |
6 |
1 |
336 |
63.1 |
3.7 |
0.094 |
0 |
0 |
0 |
0.000 |
50 |
|
L |
4 |
3 |
4553 |
◊ |
L |
x,-y,-z |
4_555 |
4 |
3 |
4553 |
63.1 |
-0.2 |
0.549 |
0 |
0 |
0 |
0.000 |
51 |
|
[EPE]A:1735 |
3 |
1 |
399 |
◊ |
B |
x,y,z |
1_555 |
7 |
2 |
52451 |
47.6 |
0.4 |
0.193 |
0 |
0 |
0 |
0.000 |
52 |
|
[ACT]B:1225 |
4 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
8 |
2 |
12177 |
47.4 |
-1.1 |
0.488 |
0 |
0 |
0 |
0.100 |
53 |
|
E |
3 |
2 |
12761 |
◊ |
B |
x,y,z |
1_555 |
8 |
1 |
52451 |
47.4 |
-0.3 |
0.562 |
0 |
0 |
0 |
0.000 |
54 |
|
[ACT]B:1225 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
8 |
4 |
70480 |
46.2 |
0.0 |
0.675 |
0 |
0 |
0 |
0.000 |
55 |
|
[BRU]T:22 |
5 |
1 |
452 |
◊ |
P |
x,y,z |
1_555 |
7 |
1 |
1387 |
41.5 |
-1.3 |
0.457 |
1 |
0 |
0 |
0.079 |
56 |
|
C |
4 |
1 |
16399 |
◊ |
B |
x,-y,-z |
4_555 |
3 |
1 |
52451 |
37.7 |
-0.7 |
0.295 |
0 |
0 |
0 |
0.000 |
57 |
|
[MG]A:2458 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
70480 |
35.7 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.039 |
58 |
|
[MG]A:2458 |
1 |
1 |
98 |
◊ |
P |
x,y,z |
1_555 |
3 |
2 |
1387 |
31.5 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.010 |
59 |
|
N |
5 |
2 |
1820 |
◊ |
B |
x,y,z |
1_555 |
4 |
3 |
52451 |
31.1 |
-1.2 |
0.330 |
0 |
0 |
0 |
0.003 |
60 |
|
[ACT]A:1734 |
2 |
1 |
183 |
◊ |
E |
x,y,z |
1_555 |
2 |
1 |
12761 |
28.9 |
1.0 |
0.837 |
1 |
0 |
0 |
0.000 |
61 |
|
S |
4 |
2 |
11730 |
◊ |
E |
x,y,z |
1_555 |
4 |
2 |
12761 |
27.6 |
0.6 |
0.790 |
0 |
0 |
0 |
0.000 |
62 |
|
[EPE]A:1735 |
3 |
1 |
399 |
f |
G |
-x+1,y,-z-1/2 |
3_654 |
1 |
1 |
9931 |
24.3 |
0.8 |
0.166 |
1 |
0 |
0 |
0.000 |
63 |
|
L |
1 |
1 |
4553 |
◊ |
K |
x,y,z |
1_555 |
5 |
2 |
8665 |
21.1 |
0.3 |
0.704 |
0 |
0 |
0 |
0.000 |
64 |
|
[ZN]C:1269 |
1 |
1 |
98 |
f |
A |
x,-y,-z |
4_555 |
1 |
1 |
70480 |
16.3 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.048 |
65 |
|
[MG]A:2458 |
1 |
1 |
98 |
◊ |
S |
x,y,z |
1_555 |
2 |
1 |
11730 |
11.2 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.004 |
66 |
|
[ZN]B:2225 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
70480 |
10.6 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.035 |
67 |
|
[PGE]L:71 |
2 |
1 |
336 |
f |
L |
x,-y,-z |
4_555 |
2 |
2 |
4553 |
7.6 |
-0.1 |
0.251 |
0 |
0 |
0 |
0.100 |
68 |
|
G |
3 |
1 |
9931 |
◊ |
B |
-x+1,y,-z-1/2 |
3_654 |
1 |
1 |
52451 |
4.5 |
-0.1 |
0.465 |
0 |
0 |
0 |
0.000 |
69 |
|
[MG]A:2458 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
52451 |
2.7 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
70 |
|
H |
1 |
1 |
8545 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
52451 |
1.9 |
0.0 |
0.586 |
0 |
0 |
0 |
0.000 |
71 |
|
[BRU]T:22 |
1 |
1 |
452 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
70480 |
1.1 |
-0.1 |
0.425 |
0 |
0 |
0 |
0.000 |
72 |
|
[PGE]L:71 |
1 |
1 |
336 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
52451 |
0.4 |
0.0 |
0.243 |
0 |
0 |
0 |
0.000 |
|