Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "49a457aaf5ae2861a6d1c1710164d3a5",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 78.447,
"b": 78.447,
"c": 36.951,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.54184],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [22.19,1.597],
"number_observations_unique": 30056,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.189
},
{
"type": "I/SigI",
"value": 17.690
},
{
"type": "Completeness",
"value": 99.920
},
{
"type": "Redundancy",
"value": 9.850
}
]
},
"refln_shells": [
{
"resolution_limits": [1.654,1.597],
"number_observations_unique": 30056,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.425
}
]
},
{
"resolution_limits": [1.721,1.654],
"number_observations_unique": 27106,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.360
}
]
},
{
"resolution_limits": [1.799,1.721],
"number_observations_unique": 24152,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.288
}
]
},
{
"resolution_limits": [1.894,1.799],
"number_observations_unique": 21149,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.226
}
]
},
{
"resolution_limits": [2.012,1.894],
"number_observations_unique": 18187,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.200
}
]
},
{
"resolution_limits": [2.168,2.012],
"number_observations_unique": 15159,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.194
}
]
},
{
"resolution_limits": [2.385,2.168],
"number_observations_unique": 12173,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.188
}
]
},
{
"resolution_limits": [2.730,2.385],
"number_observations_unique": 9175,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.187
}
]
},
{
"resolution_limits": [3.438,2.730],
"number_observations_unique": 6160,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.178
}
]
},
{
"resolution_limits": [22.19,3.438],
"number_observations_unique": 3115,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.171
}
]
}
]
}