Ligand · BU2
BU2 · 1,3-butanediol
BU2, 1,3-butanediol (C4 H10 O2, 90.1 g/mol), in the MolNFT structures on GenesisL1: bound in 12 records (9 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found with it.
- Component
- BU2
- Formula
- C4 H10 O2
- Class
- additive
- Structures
- 12
- PDB entries
- 9
Binding sites
BU2 in 12 structures; the first of them:
- 5EKY · Crystal structure of deoxyribose-phosphate aldolase from Escherichia coli (K58E-Y96W… · BU2 A301 · binds THR18, LEU20, CYS47, VAL73, ASP102, LYS167, SER169, THR170 and 4 more
- 5I3T · Native Structure of the Linalool Dehydratase-Isomerase from Castellaniella defragrans · BU2 A501 · binds VAL92, TYR95, TYR269, TRP273, VAL322, LEU324, LEU370, LEU371 and 2 more
- 5MEX · Sulphotransferase-18 from Arabidopsis thaliana in complex with 3'-phosphoadenosine… · BU2 A413 · binds ARG51, LEU190, HIS191, GLU193, GLY198, PRO199
- 7C6I · Crystal structure of beta-glycosides-binding protein (W177X) of ABC transporter in an… · BU2 B504 · binds LYS405, GLY190, GLY191, GLU192, ARG195, ALA204
- 7D30 · Structure of sybody MR17-SR31 fusion in complex with the SARS-CoV-2 S Receptor Binding… · BU2 A1309 · binds SER1000, ALA1024, SER1025, GLY1026, PHE1027, PRO1028, ASN1077
- 8IGI · Crystal structure of HP1526 (XthA)- a base excision DNA repair protein in Helicobacter… · BU2 A303 · binds ASN108, ASN146, ALA164, TRP199, TRP213, ILE215
- 5MEX · Sulphotransferase-18 from arabidopsis thaliana in complex with 3'- phosphoadenosine… · BU2 A413 · binds ARG51, LEU190, HIS191, GLU193, GLY198, PRO199
- 6EQS · Human SIRT5 in complex with stalled peptidylimidate intermediate of inhibitory compound 29 · BU2 A408 · binds CYS181, PRO182, GLU202, LYS203, LEU204, PRO205, ARG206, GLU208
- 6UMJ · Crystal structure of erenumab Fab-C · BU2 H301 · binds GLY33, HIS35, VAL50, SER52, ILE57, ASP99, TYR104, TYR112 and 2 more
- 7C6I · Crystal structure of beta-glycosides-binding protein (W177X) of ABC transporter in an… · BU2 B504 · binds GLY190, GLY191, GLU192, ARG195
- 7D30 · Structure of sybody MR17-SR31 fusion in complex with the SARS-cov-2 S receptor binding… · BU2 A1309 · binds ALA1024, SER1025, GLY1026, PHE1027, ASN1077
- 7TWA · Crystal structure of apo besc from streptomyces cattleya · BU2 C301 · binds LEU85, GLU112, TYR157, ASP172, SER176
Residues it binds most
GLY 12, VAL 10, ASN 11, LEU 11, TYR 11, PHE 9, ALA 11, PRO 10, GLU 9, SER 9 (residue and the binding sites it lines).
Found with
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