HARIBOSS

Harnessing RIBOnucleic acid - Small molecules Structures

Complex 4w2i

System information

Experimental technique X-ray
Experimental resolution 2.70
System mass 4555.29 kDa
Deposition year 2014
Molecule type RNA/Protein
# RNA entities 6
Organism Thermus
RCSB PDB Entry 4w2i
Reference Polikanov Yury S., Szal Teresa, Jiang Fuyan, Gupta Pulkit, Matsuda Ryoichi, Shiozuka Masataka, Steitz Thomas A., Vázquez-Laslop Nora, Mankin Alexander S.. . Negamycin Interferes with Decoding and Translocation by Simultaneous Interaction with rRNA and tRNA Molecular Cell

Compound NEG
Residue . / 3216
Chain PL / AA
Non-redundant True
Interacting RNA chains W/AW, A/AA
Volume 630.78 Å3
Hydrophobicity 0.259
Hydrophilicity 1.219
Buriedness 0.767
Don/acc character 0.962
SiteScore 1.046
D Score 1.003

Compound NEG
Residue . / 3218
Chain RL / AA
Non-redundant False
Interacting RNA chains A/AA
Volume 183.50 Å3
Hydrophobicity 0.108
Hydrophilicity 1.060
Buriedness 0.637
Don/acc character 1.359
SiteScore 0.723
D Score 0.674

Compound NEG
Residue . / 3219
Chain SL / AA
Non-redundant False
Interacting RNA chains A/AA
Volume -
Hydrophobicity -
Hydrophilicity -
Buriedness -
Don/acc character -
SiteScore -
D Score -

Compound NEG
Residue . / 3220
Chain TL / AA
Non-redundant False
Interacting RNA chains Z/BA
Volume 446.59 Å3
Hydrophobicity 0.125
Hydrophilicity 1.488
Buriedness 0.732
Don/acc character 1.147
SiteScore 1.023
D Score 0.894

Compound NEG
Residue . / 3221
Chain UL / AA
Non-redundant True
Interacting RNA chains Z/BA
Volume 471.97 Å3
Hydrophobicity 0.206
Hydrophilicity 1.211
Buriedness 0.697
Don/acc character 1.063
SiteScore 0.938
D Score 0.885

Compound NEG
Residue . / 3004
Chain QM / AW
Non-redundant True
Interacting RNA chains Z/BA
Volume 1139.79 Å3
Hydrophobicity 0.128
Hydrophilicity 1.295
Buriedness 0.732
Don/acc character 0.898
SiteScore 1.022
D Score 0.957

Compound NEG
Residue . / 3013
Chain EN / AX
Non-redundant True
Interacting RNA chains Z/BA
Volume 340.26 Å3
Hydrophobicity 0.175
Hydrophilicity 1.266
Buriedness 0.731
Don/acc character 1.500
SiteScore 0.977
D Score 0.908

Compound NEG
Residue . / 3170
Chain PCB / CA
Non-redundant True
Interacting RNA chains EB/CA, AC/CW
Volume 644.84 Å3
Hydrophobicity 0.156
Hydrophilicity 1.319
Buriedness 0.759
Don/acc character 0.941
SiteScore 1.040
D Score 0.965

Compound NEG
Residue . / 3172
Chain RCB / CA
Non-redundant True
Interacting RNA chains EB/CA
Volume 103.59 Å3
Hydrophobicity 0.024
Hydrophilicity 1.130
Buriedness 0.630
Don/acc character 1.543
SiteScore 0.668
D Score 0.582

Compound NEG
Residue . / 3173
Chain SCB / CA
Non-redundant True
Interacting RNA chains EB/CA
Volume -
Hydrophobicity -
Hydrophilicity -
Buriedness -
Don/acc character -
SiteScore -
D Score -

Compound NEG
Residue . / 3174
Chain TCB / CA
Non-redundant True
Interacting RNA chains DC/DA
Volume 468.88 Å3
Hydrophobicity 0.165
Hydrophilicity 1.364
Buriedness 0.714
Don/acc character 1.199
SiteScore 1.011
D Score 0.924

Compound NEG
Residue . / 3175
Chain UCB / CA
Non-redundant True
Interacting RNA chains DC/DA
Volume 417.09 Å3
Hydrophobicity 0.194
Hydrophilicity 1.197
Buriedness 0.695
Don/acc character 0.699
SiteScore 0.887
D Score 0.824

Compound NEG
Residue . / 3002
Chain LDB / CW
Non-redundant False
Interacting RNA chains DC/DA
Volume 1031.06 Å3
Hydrophobicity 0.165
Hydrophilicity 1.252
Buriedness 0.727
Don/acc character 0.779
SiteScore 1.019
D Score 0.968

Compound NEG
Residue . / 3004
Chain QDB / CX
Non-redundant True
Interacting RNA chains DC/DA
Volume 354.32 Å3
Hydrophobicity 0.118
Hydrophilicity 1.280
Buriedness 0.718
Don/acc character 1.437
SiteScore 1.013
D Score 0.953