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5MW3

Crystal structure of Dot1L in complex with inhibitor CPD1 [N6-(2,6-dichlorophenyl)-N6-(pent-2-yn-1-yl)quinoline-4,6-diamine] and inhibitor CPD2 [(R)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidin-3-amine]

Functional Information from GO Data
ChainGOidnamespacecontents
A0031151molecular_functionhistone H3K79 methyltransferase activity
A0051726biological_processregulation of cell cycle
B0031151molecular_functionhistone H3K79 methyltransferase activity
B0051726biological_processregulation of cell cycle
Functional Information from PDB Data
site_idAC1
Number of Residues13
Detailsbinding site for residue 5JJ A 401
ChainResidue
APHE131
ASER269
AVAL310
ASER311
AHOH518
ASER140
ALEU143
AVAL144
APHE239
AVAL240
AASN241
AVAL267
ASER268

site_idAC2
Number of Residues9
Detailsbinding site for residue 5JT A 402
ChainResidue
AGLY163
AGLU186
ALYS187
AGLY221
AASP222
APHE223
APHE245
AHOH539
AHOH573

site_idAC3
Number of Residues8
Detailsbinding site for residue TLA A 403
ChainResidue
AGLY246
APRO247
AGLU248
AVAL249
ALYS330
AHOH519
AHOH536
AHOH599

site_idAC4
Number of Residues14
Detailsbinding site for residue 5JJ B 401
ChainResidue
BPHE131
BSER140
BLEU143
BVAL144
BPHE239
BVAL240
BASN241
BVAL267
BSER268
BSER269
BVAL310
BSER311
BHOH510
BHOH624

site_idAC5
Number of Residues8
Detailsbinding site for residue 5JT B 402
ChainResidue
BGLY163
BGLU186
BLYS187
BGLY221
BASP222
BPHE223
BPHE245
BHOH553

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues8
DetailsBINDING:
ChainResidueDetails
ATYR136
APHE159
AGLU186
AASP222
BTYR136
BPHE159
BGLU186
BASP222

site_idSWS_FT_FI2
Number of Residues2
DetailsMOD_RES: Phosphoserine => ECO:0007744|PubMed:23186163
ChainResidueDetails
ASER297
BSER297

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PDB entries from 2024-07-17

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