Binding Site Information of Target
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T85309 | Target Info | |||
| Target Name | Cystathionine beta-synthase (CBS) | ||||
| Synonyms | Serine sulfhydrase; Beta-thionase | ||||
| Target Type | Clinical trial Target | ||||
| Gene Name | CBS | ||||
| Biochemical Class | Alpha-carbonic anhydrase | ||||
| UniProt ID | |||||
| Drug Binding Sites of Target | Top | |||||
|---|---|---|---|---|---|---|
| Ligand Name: Pyridoxal phosphate | Ligand Info | |||||
| Structure Description | Crystal structure of human cystathionine beta-synthase (delta516-525) at 2.0 angstrom resolution | PDB:4COO | ||||
| Method | X-ray diffraction | Resolution | 2.00 Å | Mutation | No | [1] |
| PDB Sequence |
WIRPDAPSRC
52 TWQLGRPASE62 SPHHHTAPAK72 SPKILPDILK82 KIGDTPMVRI92 NKIGKKFGLK 102 CELLAKCEFF112 NAGGSVKDRI122 SLRMIEDAER132 DGTLKPGDTI142 IEPTSGNTGI 152 GLALAAAVRG162 YRCIIVMPEK172 MSSEKVDVLR182 ALGAEIVRTP192 TNARFDSPES 202 HVGVAWRLKN212 EIPNSHILDQ222 YRNASNPLAH232 YDTTADEILQ242 QCDGKLDMLV 252 ASVGTGGTIT262 GIARKLKEKC272 PGCRIIGVDP282 EGSILAEPEE292 LNQTEQTTYE 302 VEGIGYDFIP312 TVLDRTVVDK322 WFKSNDEEAF332 TFARMLIAQE342 GLLCGGSAGS 352 TVAVAVKAAQ362 ELQEGQRCVV372 ILPDSVRNYM382 TKFLSDRWML392 QKGFLKEEDL 402 TEKKPWWWHL412 RVQELGLSAP422 LTVLPTITCG432 HTIEILREKG442 FDQAPVVDEA 452 GVILGMVTLG462 NMLSSLLAGK472 VQPSDQVGKV482 IYKQFKQIRL492 TDTLGRLSHI 502 LEMDHFALVV512 HEQMVFGVVT535 AIDLLNFVAA545 QER
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VAL118
4.629
LYS119
1.631
SER147
4.724
ASN149
2.893
ASN228
4.686
HIS232
4.328
SER254
3.567
VAL255
3.696
GLY256
2.872
THR257
2.701
GLY258
2.865
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| Click to View More Binding Site Information of This Target and Ligand Pair | ||||||
| Ligand Name: Ademetionine | Ligand Info | |||||
| Structure Description | 1.7 A resolution structure of human cystathionine beta-synthase regulatory domain (del 516-525) in complex with SAM | PDB:4UUU | ||||
| Method | X-ray diffraction | Resolution | 1.71 Å | Mutation | No | [1] |
| PDB Sequence |
NLYFQSMKPW
408 WWHLRVQELG418 LSAPLTVLPT428 ITCGHTIEIL438 REKGFDQAPV448 VDEAGVILGM 458 VTLGNMLSSL468 LAGKVQPSDQ478 VGKVIYKQFK488 QIRLTDTLGR498 LSHILEMDHF 508 ALVVHEQQRQ528 MVFGVVTAID538 LLNFVAA
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| Click to View More Binding Site Information of This Target and Ligand Pair | ||||||
| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Inter-domain communication of human cystathionine beta-synthase: structural basis of S-adenosyl-L-methionine activation. J Biol Chem. 2014 Dec 26;289(52):36018-30. | ||||
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