## |
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 |
|
H |
194 |
45 |
12191 |
◊ |
G |
x,y,z |
1_555 |
186 |
45 |
12264 |
1726.9 |
-12.5 |
0.155 |
30 |
20 |
0 |
0.410 |
2 |
|
B |
187 |
44 |
12213 |
◊ |
A |
x,y,z |
1_555 |
189 |
44 |
12185 |
1715.2 |
-14.6 |
0.098 |
31 |
21 |
0 |
0.410 |
3 |
|
D |
188 |
45 |
12200 |
◊ |
C |
x,y,z |
1_555 |
181 |
44 |
12262 |
1713.3 |
-13.2 |
0.130 |
31 |
21 |
0 |
0.410 |
4 |
|
F |
188 |
44 |
12179 |
◊ |
E |
x,y,z |
1_555 |
187 |
45 |
12209 |
1701.9 |
-13.9 |
0.109 |
30 |
19 |
0 |
0.410 |
Average: |
1714.3 |
-13.6 |
0.123 |
31 |
20 |
0 |
0.410 |
2 |
5 |
|
C |
146 |
41 |
12262 |
◊ |
B |
x,y,z |
1_555 |
147 |
40 |
12213 |
1376.0 |
-12.1 |
0.102 |
27 |
7 |
0 |
0.356 |
6 |
|
G |
146 |
41 |
12264 |
◊ |
F |
x,y,z |
1_555 |
151 |
41 |
12179 |
1370.2 |
-10.9 |
0.138 |
24 |
7 |
0 |
0.356 |
7 |
|
H |
145 |
40 |
12191 |
◊ |
E |
x,y,z |
1_555 |
145 |
41 |
12209 |
1340.9 |
-12.5 |
0.104 |
21 |
9 |
0 |
0.356 |
8 |
|
D |
141 |
40 |
12200 |
◊ |
A |
x,y,z |
1_555 |
143 |
40 |
12185 |
1328.3 |
-12.6 |
0.099 |
23 |
10 |
0 |
0.356 |
Average: |
1353.8 |
-12.0 |
0.111 |
24 |
8 |
0 |
0.356 |
3 |
9 |
|
E |
104 |
28 |
12209 |
◊ |
A |
x,y,z |
1_555 |
97 |
26 |
12185 |
1008.3 |
-4.3 |
0.387 |
13 |
9 |
0 |
0.111 |
10 |
|
C |
99 |
28 |
12262 |
◊ |
F |
x,y-1,z |
1_545 |
98 |
27 |
12179 |
991.9 |
-6.0 |
0.256 |
11 |
10 |
0 |
0.111 |
11 |
|
G |
97 |
26 |
12264 |
◊ |
B |
x,y,z-1 |
1_554 |
95 |
27 |
12213 |
976.6 |
-6.4 |
0.229 |
11 |
10 |
0 |
0.111 |
Average: |
992.3 |
-5.6 |
0.291 |
12 |
10 |
0 |
0.111 |
4 |
12 |
|
[NAP]H:1257 |
47 |
1 |
874 |
f |
H |
x,y,z |
1_555 |
92 |
36 |
12191 |
590.0 |
-3.7 |
0.447 |
21 |
0 |
0 |
0.373 |
13 |
|
[NAP]B:1257 |
46 |
1 |
882 |
f |
B |
x,y,z |
1_555 |
91 |
36 |
12213 |
589.7 |
-3.9 |
0.427 |
21 |
0 |
0 |
0.373 |
14 |
|
[NAP]D:1257 |
48 |
1 |
875 |
f |
D |
x,y,z |
1_555 |
88 |
34 |
12200 |
588.9 |
-3.9 |
0.455 |
21 |
0 |
0 |
0.373 |
15 |
|
[NAP]E:1257 |
46 |
1 |
884 |
f |
E |
x,y,z |
1_555 |
88 |
34 |
12209 |
588.0 |
-4.0 |
0.434 |
19 |
0 |
0 |
0.373 |
16 |
|
[NAP]G:1257 |
47 |
1 |
883 |
f |
G |
x,y,z |
1_555 |
95 |
36 |
12264 |
583.1 |
-3.8 |
0.426 |
20 |
0 |
0 |
0.373 |
17 |
|
[NAP]C:1257 |
48 |
1 |
880 |
f |
C |
x,y,z |
1_555 |
89 |
34 |
12262 |
581.9 |
-4.2 |
0.412 |
19 |
0 |
0 |
0.373 |
18 |
|
[NAP]F:1257 |
48 |
1 |
873 |
f |
F |
x,y,z |
1_555 |
91 |
36 |
12179 |
578.9 |
-3.5 |
0.470 |
20 |
0 |
0 |
0.373 |
19 |
|
[NAP]A:1257 |
46 |
1 |
880 |
f |
A |
x,y,z |
1_555 |
87 |
33 |
12185 |
575.3 |
-4.0 |
0.432 |
19 |
0 |
0 |
0.373 |
Average: |
584.5 |
-3.9 |
0.438 |
20 |
0 |
0 |
0.373 |
5 |
20 |
|
C |
56 |
16 |
12262 |
◊ |
A |
x,y,z |
1_555 |
53 |
13 |
12185 |
563.0 |
0.7 |
0.672 |
9 |
4 |
0 |
0.039 |
21 |
|
G |
53 |
13 |
12264 |
◊ |
E |
x,y,z |
1_555 |
55 |
14 |
12209 |
546.3 |
0.5 |
0.657 |
8 |
4 |
0 |
0.039 |
22 |
|
D |
56 |
13 |
12200 |
◊ |
B |
x,y,z |
1_555 |
54 |
14 |
12213 |
541.7 |
-0.8 |
0.544 |
7 |
3 |
0 |
0.039 |
23 |
|
H |
55 |
13 |
12191 |
◊ |
F |
x,y,z |
1_555 |
51 |
13 |
12179 |
523.9 |
-0.6 |
0.557 |
6 |
1 |
0 |
0.039 |
Average: |
543.7 |
-0.1 |
0.607 |
8 |
3 |
0 |
0.039 |
6 |
24 |
|
D |
30 |
11 |
12200 |
◊ |
H |
x-1,y-1,z |
1_445 |
28 |
11 |
12191 |
299.3 |
7.5 |
0.978 |
5 |
6 |
0 |
0.000 |
7 |
25 |
|
[W1G]B:1258 |
15 |
1 |
433 |
f |
B |
x,y,z |
1_555 |
50 |
19 |
12213 |
264.6 |
-6.8 |
0.284 |
1 |
0 |
0 |
0.213 |
26 |
|
[W1G]F:1258 |
15 |
1 |
432 |
f |
F |
x,y,z |
1_555 |
47 |
19 |
12179 |
263.0 |
-6.8 |
0.284 |
1 |
0 |
0 |
0.213 |
27 |
|
[W1G]E:1258 |
16 |
1 |
433 |
f |
E |
x,y,z |
1_555 |
49 |
18 |
12209 |
261.4 |
-6.7 |
0.315 |
1 |
0 |
0 |
0.213 |
28 |
|
[W1G]D:1258 |
15 |
1 |
434 |
f |
D |
x,y,z |
1_555 |
46 |
18 |
12200 |
258.5 |
-6.7 |
0.299 |
1 |
0 |
0 |
0.213 |
29 |
|
[W1G]A:1258 |
15 |
1 |
433 |
f |
A |
x,y,z |
1_555 |
45 |
18 |
12185 |
258.1 |
-6.6 |
0.312 |
1 |
0 |
0 |
0.213 |
30 |
|
[W1G]C:1258 |
16 |
1 |
429 |
f |
C |
x,y,z |
1_555 |
45 |
18 |
12262 |
256.9 |
-6.6 |
0.320 |
1 |
0 |
0 |
0.213 |
31 |
|
[W1G]G:1258 |
16 |
1 |
432 |
f |
G |
x,y,z |
1_555 |
46 |
18 |
12264 |
256.7 |
-6.7 |
0.316 |
1 |
0 |
0 |
0.213 |
32 |
|
[W1G]H:1258 |
15 |
1 |
427 |
f |
H |
x,y,z |
1_555 |
41 |
17 |
12191 |
255.6 |
-6.5 |
0.289 |
1 |
0 |
0 |
0.213 |
Average: |
259.3 |
-6.7 |
0.302 |
1 |
0 |
0 |
0.213 |
8 |
33 |
|
F |
28 |
9 |
12179 |
◊ |
H |
x-1,y,z |
1_455 |
21 |
7 |
12191 |
198.6 |
4.5 |
0.931 |
6 |
3 |
0 |
0.000 |
9 |
34 |
|
C |
12 |
3 |
12262 |
◊ |
G |
x,y-1,z+1 |
1_546 |
10 |
3 |
12264 |
110.9 |
0.0 |
0.572 |
0 |
1 |
0 |
0.000 |
10 |
35 |
|
[W1G]A:1258 |
11 |
1 |
433 |
f |
[NAP]A:1257 |
x,y,z |
1_555 |
15 |
1 |
880 |
97.9 |
-2.3 |
0.625 |
1 |
0 |
0 |
0.079 |
36 |
|
[W1G]D:1258 |
10 |
1 |
434 |
f |
[NAP]D:1257 |
x,y,z |
1_555 |
16 |
1 |
875 |
97.9 |
-2.1 |
0.639 |
1 |
0 |
0 |
0.079 |
37 |
|
[W1G]G:1258 |
11 |
1 |
432 |
f |
[NAP]G:1257 |
x,y,z |
1_555 |
16 |
1 |
883 |
97.7 |
-2.2 |
0.627 |
1 |
0 |
0 |
0.079 |
38 |
|
[W1G]B:1258 |
10 |
1 |
433 |
f |
[NAP]B:1257 |
x,y,z |
1_555 |
16 |
1 |
882 |
97.6 |
-2.3 |
0.624 |
1 |
0 |
0 |
0.079 |
39 |
|
[W1G]E:1258 |
10 |
1 |
433 |
f |
[NAP]E:1257 |
x,y,z |
1_555 |
16 |
1 |
884 |
96.4 |
-2.2 |
0.634 |
1 |
0 |
0 |
0.079 |
40 |
|
[W1G]C:1258 |
10 |
1 |
429 |
f |
[NAP]C:1257 |
x,y,z |
1_555 |
17 |
1 |
880 |
96.1 |
-2.1 |
0.654 |
1 |
0 |
0 |
0.079 |
41 |
|
[W1G]H:1258 |
10 |
1 |
427 |
f |
[NAP]H:1257 |
x,y,z |
1_555 |
16 |
1 |
874 |
95.5 |
-2.3 |
0.606 |
1 |
0 |
0 |
0.079 |
42 |
|
[W1G]F:1258 |
10 |
1 |
432 |
f |
[NAP]F:1257 |
x,y,z |
1_555 |
16 |
1 |
873 |
95.4 |
-2.2 |
0.620 |
1 |
0 |
0 |
0.079 |
Average: |
96.8 |
-2.2 |
0.629 |
1 |
0 |
0 |
0.079 |
11 |
43 |
|
E |
11 |
5 |
12209 |
◊ |
B |
x,y,z |
1_555 |
11 |
7 |
12213 |
92.9 |
2.2 |
0.818 |
0 |
2 |
0 |
0.000 |
44 |
|
G |
10 |
4 |
12264 |
◊ |
A |
x,y,z-1 |
1_554 |
11 |
6 |
12185 |
81.0 |
1.0 |
0.752 |
1 |
1 |
0 |
0.000 |
45 |
|
F |
9 |
5 |
12179 |
◊ |
A |
x,y,z |
1_555 |
8 |
4 |
12185 |
80.9 |
1.6 |
0.753 |
0 |
1 |
0 |
0.000 |
46 |
|
D |
9 |
6 |
12200 |
◊ |
F |
x,y-1,z |
1_545 |
6 |
4 |
12179 |
78.1 |
1.1 |
0.729 |
0 |
0 |
0 |
0.000 |
47 |
|
C |
8 |
4 |
12262 |
◊ |
E |
x,y-1,z |
1_545 |
11 |
6 |
12209 |
77.1 |
0.7 |
0.687 |
1 |
1 |
0 |
0.000 |
48 |
|
H |
9 |
5 |
12191 |
◊ |
B |
x,y,z-1 |
1_554 |
6 |
3 |
12213 |
51.0 |
0.9 |
0.720 |
0 |
0 |
0 |
0.000 |
Average: |
76.8 |
1.3 |
0.743 |
0 |
1 |
0 |
0.000 |
12 |
49 |
|
[NAP]A:1257 |
4 |
1 |
880 |
◊ |
E |
x,y,z |
1_555 |
3 |
1 |
12209 |
33.6 |
0.7 |
0.751 |
0 |
0 |
0 |
0.000 |
50 |
|
[NAP]G:1257 |
4 |
1 |
883 |
◊ |
B |
x,y,z-1 |
1_554 |
3 |
1 |
12213 |
31.9 |
0.6 |
0.734 |
0 |
0 |
0 |
0.000 |
51 |
|
[NAP]C:1257 |
3 |
1 |
880 |
◊ |
F |
x,y-1,z |
1_545 |
3 |
1 |
12179 |
29.9 |
0.7 |
0.762 |
0 |
0 |
0 |
0.000 |
52 |
|
C |
2 |
1 |
12262 |
◊ |
[NAP]F:1257 |
x,y-1,z |
1_545 |
3 |
1 |
873 |
20.7 |
0.5 |
0.735 |
0 |
0 |
0 |
0.000 |
53 |
|
G |
1 |
1 |
12264 |
◊ |
[NAP]B:1257 |
x,y,z-1 |
1_554 |
1 |
1 |
882 |
15.2 |
0.4 |
0.797 |
0 |
0 |
0 |
0.000 |
54 |
|
[NAP]E:1257 |
2 |
1 |
884 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
12185 |
14.8 |
0.4 |
0.706 |
0 |
0 |
0 |
0.000 |
Average: |
24.4 |
0.6 |
0.748 |
0 |
0 |
0 |
0.000 |
13 |
55 |
|
A |
1 |
1 |
12185 |
◊ |
H |
x-1,y,z |
1_455 |
1 |
1 |
12191 |
0.9 |
0.0 |
0.718 |
0 |
0 |
0 |
0.000 |
|